Exact Mass: 558.3152

Exact Mass Matches: 558.3152

Found 244 metabolites which its exact mass value is equals to given mass value 558.3152, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Cucurbitacin B

(R,E)-6-((2S,8S,9R,10R,13R,14S,16R,17R)-2,16-dihydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl acetate

C32H46O8 (558.3193)


Together wth other cucurbitacins, is responsible for the bitter taste and toxic props. of spoilt cucumbers. Cucurbitacin B is found in many foods, some of which are muskmelon, bitter gourd, green vegetables, and cucumber. Cucurbitacin B is found in bitter gourd. Together wth other cucurbitacins, is responsible for the bitter taste and toxic properties of spoilt cucumber Cucurbitacin B is a cucurbitacin in which a lanostane skeleton is multi-substituted with hydroxy, methyl and oxo substituents, with unsaturation at positions 5 and 23; a hydroxy function at C-25 is acetylated. It is a cucurbitacin, a secondary alpha-hydroxy ketone and a tertiary alpha-hydroxy ketone. It derives from a hydride of a lanostane. Cucurbitacin B is a natural product found in Begonia plebeja, Trichosanthes miyagii, and other organisms with data available. Cucurbitacin B belongs to a class of highly oxidized tetracyclic triterpenoids and is oral active. Cucurbitacin B inhibits tumor cell growth, migration and invasion and cycle arrest, but induces cell apoptosis. Cucurbitacin B has potent anti-inflammatory, antioxidant, antiviral, hypoglycemic, hepatoprotective, neuroprotective activity[1][2][3][4][5]. Cucurbitacin B belongs to a class of highly oxidized tetracyclic triterpenoids and is oral active. Cucurbitacin B inhibits tumor cell growth, migration and invasion and cycle arrest, but induces cell apoptosis. Cucurbitacin B has potent anti-inflammatory, antioxidant, antiviral, hypoglycemic, hepatoprotective, neuroprotective activity[1][2][3][4][5]. (+)-Cucurbitacin B. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=6199-67-3 (retrieved 2024-08-12) (CAS RN: 6199-67-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

   

Isocucurbitacin B

[(E,6R)-6-[(3S,8S,9R,10R,13R,14S,16R,17R)-3,16-dihydroxy-4,4,9,13,14-pentamethyl-2,11-dioxo-3,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl] acetate

C32H46O8 (558.3193)


Isocucurbitacin B is a natural product found in Helicteres isora, Cucurbita foetidissima, and other organisms with data available.

   

Kadsuphilactone A

(+)-Kadsuphilactone A

C32H46O8 (558.3193)


   

13beta-Hydroxymilbemycin A4

13beta-Hydroxymilbemycin A4

C32H46O8 (558.3193)


   

3-O-Acetylganoderic acid K.

3-O-Acetylganoderic acid K.

C32H46O8 (558.3193)


   

Dihydrocucurbitacin E

Dihydrocucurbitacin E

C32H46O8 (558.3193)


   

Gamabufotalin-3-hemisuberat|Gamabufotalin-3-suberate|Korksaeure-mono-(3-gamabufotalylester)|Korksaeure-mono-3-gamabufotalylester

Gamabufotalin-3-hemisuberat|Gamabufotalin-3-suberate|Korksaeure-mono-(3-gamabufotalylester)|Korksaeure-mono-3-gamabufotalylester

C32H46O8 (558.3193)


   

echinoclasterol sulfate phenethylammonium salt

echinoclasterol sulfate phenethylammonium salt

C29H50O8S (558.3226)


   

cytosporolide B

cytosporolide B

C32H46O8 (558.3193)


   

3-Epi-Isocucurbitacin B

3-Epi-Isocucurbitacin B

C32H46O8 (558.3193)


   

milbemycin alpha27

milbemycin alpha27

C32H46O8 (558.3193)


   

12-O-(4Z)-deca-4-enoylphorbol-13-acetate

12-O-(4Z)-deca-4-enoylphorbol-13-acetate

C32H46O8 (558.3193)


   

23,24-dihydrocucurbitacin E|dihydrocucurbitacin E

23,24-dihydrocucurbitacin E|dihydrocucurbitacin E

C32H46O8 (558.3193)


   

milbemycin alpha24

milbemycin alpha24

C32H46O8 (558.3193)


   

12beta-acetoxy-3beta,7beta-dihydroxy-11,15-dioxo-lanosta-8,24(E)-dien-26-oic acid|ganoderic acid GS-3

12beta-acetoxy-3beta,7beta-dihydroxy-11,15-dioxo-lanosta-8,24(E)-dien-26-oic acid|ganoderic acid GS-3

C32H46O8 (558.3193)


   

petuniolide B

petuniolide B

C32H46O8 (558.3193)


   

piscidinol C

piscidinol C

C32H46O8 (558.3193)


   

(3beta,15alpha)-3-(acetyloxy)-15-hydroxy-7,11,23-trioxolanost-8-en-26-oic acid|3-O-acetylganoderic acid K

(3beta,15alpha)-3-(acetyloxy)-15-hydroxy-7,11,23-trioxolanost-8-en-26-oic acid|3-O-acetylganoderic acid K

C32H46O8 (558.3193)


   

tolocinobufagin-3-hemisuberate

tolocinobufagin-3-hemisuberate

C32H46O8 (558.3193)


   

(3beta,4beta,5beta,6beta,18R,22R)-5,6:18,20-diepoxy-3,18-diethoxy-4,22-dihydroxy-1-oxoergost-24-en-26-oic acid gamma-lactone|withaphysalin W

(3beta,4beta,5beta,6beta,18R,22R)-5,6:18,20-diepoxy-3,18-diethoxy-4,22-dihydroxy-1-oxoergost-24-en-26-oic acid gamma-lactone|withaphysalin W

C32H46O8 (558.3193)


   

Cucurbitacin B

acetic acid [(E,5R)-5-[(2S,8S,9R,10R,13R,14S,16R,17R)-2,16-dihydroxy-3,11-diketo-4,4,9,13,14-pentamethyl-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-5-hydroxy-4-keto-1,1-dimethyl-hex-2-enyl] ester

C32H46O8 (558.3193)


Cucurbitacin B belongs to a class of highly oxidized tetracyclic triterpenoids and is oral active. Cucurbitacin B inhibits tumor cell growth, migration and invasion and cycle arrest, but induces cell apoptosis. Cucurbitacin B has potent anti-inflammatory, antioxidant, antiviral, hypoglycemic, hepatoprotective, neuroprotective activity[1][2][3][4][5]. Cucurbitacin B belongs to a class of highly oxidized tetracyclic triterpenoids and is oral active. Cucurbitacin B inhibits tumor cell growth, migration and invasion and cycle arrest, but induces cell apoptosis. Cucurbitacin B has potent anti-inflammatory, antioxidant, antiviral, hypoglycemic, hepatoprotective, neuroprotective activity[1][2][3][4][5].

   

Petuniasterone P1

Petuniasterone P1

C32H46O8 (558.3193)


   

(3beta,7beta)-3-(acetyloxy)-7-hydroxy-11,15,23-trioxolanost-8-en-26-oic acid|3-O-acetylganoderic acid B

(3beta,7beta)-3-(acetyloxy)-7-hydroxy-11,15,23-trioxolanost-8-en-26-oic acid|3-O-acetylganoderic acid B

C32H46O8 (558.3193)


   

Petuniasterone P2

Petuniasterone P2

C32H46O8 (558.3193)


   

dihydroisocucurbitacin E

dihydroisocucurbitacin E

C32H46O8 (558.3193)


   

Asp Ile Arg Arg

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-methylpentanamido]-5-carbamimidamidopentanamido]-5-carbamimidamidopentanoic acid

C22H42N10O7 (558.3238)


   

Asp Leu Arg Arg

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-4-methylpentanamido]-5-carbamimidamidopentanamido]-5-carbamimidamidopentanoic acid

C22H42N10O7 (558.3238)


   

Asp Arg Ile Arg

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-5-carbamimidamidopentanamido]-3-methylpentanamido]-5-carbamimidamidopentanoic acid

C22H42N10O7 (558.3238)


   

Asp Arg Leu Arg

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-5-carbamimidamidopentanamido]-4-methylpentanamido]-5-carbamimidamidopentanoic acid

C22H42N10O7 (558.3238)


   

Asp Arg Arg Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido]-3-methylpentanoic acid

C22H42N10O7 (558.3238)


   

Asp Arg Arg Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido]-4-methylpentanoic acid

C22H42N10O7 (558.3238)


   

Glu Arg Arg Val

(4S)-4-amino-4-{[(1S)-4-carbamimidamido-1-{[(1S)-4-carbamimidamido-1-{[(1S)-1-carboxy-2-methylpropyl]carbamoyl}butyl]carbamoyl}butyl]carbamoyl}butanoic acid

C22H42N10O7 (558.3238)


   

Glu Arg Val Arg

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-5-carbamimidamidopentanamido]-3-methylbutanamido]-5-carbamimidamidopentanoic acid

C22H42N10O7 (558.3238)


   

Glu Val Arg Arg

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-3-methylbutanamido]-5-carbamimidamidopentanamido]-5-carbamimidamidopentanoic acid

C22H42N10O7 (558.3238)


   

Ile Asp Arg Arg

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-carboxypropanamido]-5-carbamimidamidopentanamido]-5-carbamimidamidopentanoic acid

C22H42N10O7 (558.3238)


   

Ile Ile Gln Trp

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-methylpentanamido]-4-carbamoylbutanamido]-3-(1H-indol-3-yl)propanoic acid

C28H42N6O6 (558.3166)


   

Ile Ile Trp Gln

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-4-carbamoylbutanoic acid

C28H42N6O6 (558.3166)


   

Ile Leu Gln Trp

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-4-methylpentanamido]-4-carbamoylbutanamido]-3-(1H-indol-3-yl)propanoic acid

C28H42N6O6 (558.3166)


   

Ile Leu Trp Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-4-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-4-carbamoylbutanoic acid

C28H42N6O6 (558.3166)


   

Ile Gln Ile Trp

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-4-carbamoylbutanamido]-3-methylpentanamido]-3-(1H-indol-3-yl)propanoic acid

C28H42N6O6 (558.3166)


   

Ile Gln Leu Trp

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-4-carbamoylbutanamido]-4-methylpentanamido]-3-(1H-indol-3-yl)propanoic acid

C28H42N6O6 (558.3166)


   

Ile Gln Trp Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-4-carbamoylbutanamido]-3-(1H-indol-3-yl)propanamido]-3-methylpentanoic acid

C28H42N6O6 (558.3166)


   

Ile Gln Trp Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-4-carbamoylbutanamido]-3-(1H-indol-3-yl)propanamido]-4-methylpentanoic acid

C28H42N6O6 (558.3166)


   

Ile Arg Asp Arg

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-5-carbamimidamidopentanamido]-3-carboxypropanamido]-5-carbamimidamidopentanoic acid

C22H42N10O7 (558.3238)


   

Ile Arg Arg Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido]butanedioic acid

C22H42N10O7 (558.3238)


   

Ile Trp Ile Gln

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-3-methylpentanamido]-4-carbamoylbutanoic acid

C28H42N6O6 (558.3166)


   

Ile Trp Leu Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-4-methylpentanamido]-4-carbamoylbutanoic acid

C28H42N6O6 (558.3166)


   

Ile Trp Gln Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-4-carbamoylbutanamido]-3-methylpentanoic acid

C28H42N6O6 (558.3166)


   

Ile Trp Gln Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-4-carbamoylbutanamido]-4-methylpentanoic acid

C28H42N6O6 (558.3166)


   

Lys Gln Gln Arg

(2S)-5-carbamimidamido-2-[(2S)-4-carbamoyl-2-[(2S)-4-carbamoyl-2-[(2S)-2,6-diaminohexanamido]butanamido]butanamido]pentanoic acid

C22H42N10O7 (558.3238)


   

Lys Gln Arg Gln

(2S)-2-[(2S)-5-carbamimidamido-2-[(2S)-4-carbamoyl-2-[(2S)-2,6-diaminohexanamido]butanamido]pentanamido]-4-carbamoylbutanoic acid

C22H42N10O7 (558.3238)


   

Lys Arg Gln Gln

(2S)-2-[(2S)-2-[(2S)-5-carbamimidamido-2-[(2S)-2,6-diaminohexanamido]pentanamido]-4-carbamoylbutanamido]-4-carbamoylbutanoic acid

C22H42N10O7 (558.3238)


   

Leu Asp Arg Arg

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-3-carboxypropanamido]-5-carbamimidamidopentanamido]-5-carbamimidamidopentanoic acid

C22H42N10O7 (558.3238)


   

Leu Ile Gln Trp

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-4-methylpentanamido]-3-methylpentanamido]-4-carbamoylbutanamido]-3-(1H-indol-3-yl)propanoic acid

C28H42N6O6 (558.3166)


   

Leu Ile Trp Gln

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-4-methylpentanamido]-3-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-4-carbamoylbutanoic acid

C28H42N6O6 (558.3166)


   

Leu Leu Gln Trp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-4-methylpentanamido]-4-carbamoylbutanamido]-3-(1H-indol-3-yl)propanoic acid

C28H42N6O6 (558.3166)


   

Leu Leu Trp Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-4-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-4-carbamoylbutanoic acid

C28H42N6O6 (558.3166)


   

Leu Gln Ile Trp

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-4-carbamoylbutanamido]-3-methylpentanamido]-3-(1H-indol-3-yl)propanoic acid

C28H42N6O6 (558.3166)


   

Leu Gln Leu Trp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-4-carbamoylbutanamido]-4-methylpentanamido]-3-(1H-indol-3-yl)propanoic acid

C28H42N6O6 (558.3166)


   

Leu Gln Trp Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-4-carbamoylbutanamido]-3-(1H-indol-3-yl)propanamido]-3-methylpentanoic acid

C28H42N6O6 (558.3166)


   

Leu Gln Trp Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-4-carbamoylbutanamido]-3-(1H-indol-3-yl)propanamido]-4-methylpentanoic acid

C28H42N6O6 (558.3166)


   

Leu Arg Asp Arg

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-5-carbamimidamidopentanamido]-3-carboxypropanamido]-5-carbamimidamidopentanoic acid

C22H42N10O7 (558.3238)


   

Leu Arg Arg Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido]butanedioic acid

C22H42N10O7 (558.3238)


   

Leu Trp Ile Gln

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-3-methylpentanamido]-4-carbamoylbutanoic acid

C28H42N6O6 (558.3166)


   

Leu Trp Leu Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-4-methylpentanamido]-4-carbamoylbutanoic acid

C28H42N6O6 (558.3166)


   

Leu Trp Gln Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-4-carbamoylbutanamido]-3-methylpentanoic acid

C28H42N6O6 (558.3166)


   

Leu Trp Gln Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-4-carbamoylbutanamido]-4-methylpentanoic acid

C28H42N6O6 (558.3166)


   

Met Pro Arg Arg

(2S)-2-[(2S)-2-{[(2S)-1-[(2S)-2-amino-4-(methylsulfanyl)butanoyl]pyrrolidin-2-yl]formamido}-5-carbamimidamidopentanamido]-5-carbamimidamidopentanoic acid

C22H42N10O5S (558.306)


   

Met Arg Pro Arg

(2S)-2-{[(2S)-1-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-5-carbamimidamidopentanoyl]pyrrolidin-2-yl]formamido}-5-carbamimidamidopentanoic acid

C22H42N10O5S (558.306)


   

Met Arg Arg Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-5-carbamimidamidopentanamido]-5-carbamimidamidopentanoyl]pyrrolidine-2-carboxylic acid

C22H42N10O5S (558.306)


   

Pro Met Arg Arg

(2S)-5-carbamimidamido-2-[(2S)-5-carbamimidamido-2-[(2S)-4-(methylsulfanyl)-2-[(2S)-pyrrolidin-2-ylformamido]butanamido]pentanamido]pentanoic acid

C22H42N10O5S (558.306)


   

Pro Arg Met Arg

(2S)-5-carbamimidamido-2-[(2S)-2-[(2S)-5-carbamimidamido-2-[(2S)-pyrrolidin-2-ylformamido]pentanamido]-4-(methylsulfanyl)butanamido]pentanoic acid

C22H42N10O5S (558.306)


   

Pro Arg Arg Met

(2S)-2-[(2S)-5-carbamimidamido-2-[(2S)-5-carbamimidamido-2-[(2S)-pyrrolidin-2-ylformamido]pentanamido]pentanamido]-4-(methylsulfanyl)butanoic acid

C22H42N10O5S (558.306)


   

Gln Ile Ile Trp

(2S)-2-[(2S,3S)-2-[(2S,3S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-methylpentanamido]-3-methylpentanamido]-3-(1H-indol-3-yl)propanoic acid

C28H42N6O6 (558.3166)


   

Gln Ile Leu Trp

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-methylpentanamido]-4-methylpentanamido]-3-(1H-indol-3-yl)propanoic acid

C28H42N6O6 (558.3166)


   

Gln Ile Trp Ile

(2S,3S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-3-methylpentanoic acid

C28H42N6O6 (558.3166)


   

Gln Ile Trp Leu

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-4-methylpentanoic acid

C28H42N6O6 (558.3166)


   

Gln Lys Gln Arg

(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-amino-4-carbamoylbutanamido]hexanamido]-4-carbamoylbutanamido]-5-carbamimidamidopentanoic acid

C22H42N10O7 (558.3238)


   

Gln Lys Arg Gln

(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-amino-4-carbamoylbutanamido]hexanamido]-5-carbamimidamidopentanamido]-4-carbamoylbutanoic acid

C22H42N10O7 (558.3238)


   

Gln Leu Ile Trp

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-4-methylpentanamido]-3-methylpentanamido]-3-(1H-indol-3-yl)propanoic acid

C28H42N6O6 (558.3166)


   

Gln Leu Leu Trp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-4-methylpentanamido]-4-methylpentanamido]-3-(1H-indol-3-yl)propanoic acid

C28H42N6O6 (558.3166)


   

Gln Leu Trp Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-4-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-3-methylpentanoic acid

C28H42N6O6 (558.3166)


   

Gln Leu Trp Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-4-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-4-methylpentanoic acid

C28H42N6O6 (558.3166)


   

Gln Gln Lys Arg

(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-4-carbamoylbutanamido]hexanamido]-5-carbamimidamidopentanoic acid

C22H42N10O7 (558.3238)


   

Gln Gln Arg Lys

(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-4-carbamoylbutanamido]-5-carbamimidamidopentanamido]hexanoic acid

C22H42N10O7 (558.3238)


   

Gln Arg Lys Gln

(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-5-carbamimidamidopentanamido]hexanamido]-4-carbamoylbutanoic acid

C22H42N10O7 (558.3238)


   

Gln Arg Gln Lys

(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-5-carbamimidamidopentanamido]-4-carbamoylbutanamido]hexanoic acid

C22H42N10O7 (558.3238)


   

Gln Trp Ile Ile

(2S,3S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-(1H-indol-3-yl)propanamido]-3-methylpentanamido]-3-methylpentanoic acid

C28H42N6O6 (558.3166)


   

Gln Trp Ile Leu

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-(1H-indol-3-yl)propanamido]-3-methylpentanamido]-4-methylpentanoic acid

C28H42N6O6 (558.3166)


   

Gln Trp Leu Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-(1H-indol-3-yl)propanamido]-4-methylpentanamido]-3-methylpentanoic acid

C28H42N6O6 (558.3166)


   

Gln Trp Leu Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-(1H-indol-3-yl)propanamido]-4-methylpentanamido]-4-methylpentanoic acid

C28H42N6O6 (558.3166)


   

Arg Asp Ile Arg

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-carboxypropanamido]-3-methylpentanamido]-5-carbamimidamidopentanoic acid

C22H42N10O7 (558.3238)


   

Arg Asp Leu Arg

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-carboxypropanamido]-4-methylpentanamido]-5-carbamimidamidopentanoic acid

C22H42N10O7 (558.3238)


   

Arg Asp Arg Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-carboxypropanamido]-5-carbamimidamidopentanamido]-3-methylpentanoic acid

C22H42N10O7 (558.3238)


   

Arg Asp Arg Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-carboxypropanamido]-5-carbamimidamidopentanamido]-4-methylpentanoic acid

C22H42N10O7 (558.3238)


   

Arg Glu Arg Val

(4S)-4-[(2S)-2-amino-5-carbamimidamidopentanamido]-4-{[(1S)-4-carbamimidamido-1-{[(1S)-1-carboxy-2-methylpropyl]carbamoyl}butyl]carbamoyl}butanoic acid

C22H42N10O7 (558.3238)


   

Arg Glu Val Arg

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-4-carboxybutanamido]-3-methylbutanamido]-5-carbamimidamidopentanoic acid

C22H42N10O7 (558.3238)


   

Arg Ile Asp Arg

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-methylpentanamido]-3-carboxypropanamido]-5-carbamimidamidopentanoic acid

C22H42N10O7 (558.3238)


   

Arg Ile Arg Asp

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-methylpentanamido]-5-carbamimidamidopentanamido]butanedioic acid

C22H42N10O7 (558.3238)


   

Arg Lys Gln Gln

(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-amino-5-carbamimidamidopentanamido]hexanamido]-4-carbamoylbutanamido]-4-carbamoylbutanoic acid

C22H42N10O7 (558.3238)


   

Arg Leu Asp Arg

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-4-methylpentanamido]-3-carboxypropanamido]-5-carbamimidamidopentanoic acid

C22H42N10O7 (558.3238)


   

Arg Leu Arg Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-4-methylpentanamido]-5-carbamimidamidopentanamido]butanedioic acid

C22H42N10O7 (558.3238)


   

Arg Met Pro Arg

(2S)-2-{[(2S)-1-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-4-(methylsulfanyl)butanoyl]pyrrolidin-2-yl]formamido}-5-carbamimidamidopentanoic acid

C22H42N10O5S (558.306)


   

Arg Met Arg Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-4-(methylsulfanyl)butanamido]-5-carbamimidamidopentanoyl]pyrrolidine-2-carboxylic acid

C22H42N10O5S (558.306)


   

Arg Pro Met Arg

(2S)-2-[(2S)-2-{[(2S)-1-[(2S)-2-amino-5-carbamimidamidopentanoyl]pyrrolidin-2-yl]formamido}-4-(methylsulfanyl)butanamido]-5-carbamimidamidopentanoic acid

C22H42N10O5S (558.306)


   

Arg Pro Arg Met

(2S)-2-[(2S)-2-{[(2S)-1-[(2S)-2-amino-5-carbamimidamidopentanoyl]pyrrolidin-2-yl]formamido}-5-carbamimidamidopentanamido]-4-(methylsulfanyl)butanoic acid

C22H42N10O5S (558.306)


   

Arg Gln Lys Gln

(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-4-carbamoylbutanamido]hexanamido]-4-carbamoylbutanoic acid

C22H42N10O7 (558.3238)


   

Arg Gln Gln Lys

(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-4-carbamoylbutanamido]-4-carbamoylbutanamido]hexanoic acid

C22H42N10O7 (558.3238)


   

Arg Arg Asp Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido]-3-carboxypropanamido]-3-methylpentanoic acid

C22H42N10O7 (558.3238)


   

Arg Arg Asp Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido]-3-carboxypropanamido]-4-methylpentanoic acid

C22H42N10O7 (558.3238)


   

Arg Arg Glu Val

(4S)-4-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido]-4-{[(1S)-1-carboxy-2-methylpropyl]carbamoyl}butanoic acid

C22H42N10O7 (558.3238)


   

Arg Arg Ile Asp

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido]-3-methylpentanamido]butanedioic acid

C22H42N10O7 (558.3238)


   

Arg Arg Leu Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido]-4-methylpentanamido]butanedioic acid

C22H42N10O7 (558.3238)


   

Arg Arg Met Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido]-4-(methylsulfanyl)butanoyl]pyrrolidine-2-carboxylic acid

C22H42N10O5S (558.306)


   

Arg Arg Pro Met

(2S)-2-{[(2S)-1-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-5-carbamimidamidopentanoyl]pyrrolidin-2-yl]formamido}-4-(methylsulfanyl)butanoic acid

C22H42N10O5S (558.306)


   

Arg Arg Val Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido]-3-methylbutanamido]pentanedioic acid

C22H42N10O7 (558.3238)


   

Arg Val Glu Arg

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-methylbutanamido]-4-carboxybutanamido]-5-carbamimidamidopentanoic acid

C22H42N10O7 (558.3238)


   

Arg Val Arg Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-methylbutanamido]-5-carbamimidamidopentanamido]pentanedioic acid

C22H42N10O7 (558.3238)


   

Val Glu Arg Arg

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-4-carboxybutanamido]-5-carbamimidamidopentanamido]-5-carbamimidamidopentanoic acid

C22H42N10O7 (558.3238)


   

Val Arg Glu Arg

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-5-carbamimidamidopentanamido]-4-carboxybutanamido]-5-carbamimidamidopentanoic acid

C22H42N10O7 (558.3238)


   

Val Arg Arg Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido]pentanedioic acid

C22H42N10O7 (558.3238)


   

Trp Ile Ile Gln

(2S)-2-[(2S,3S)-2-[(2S,3S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-3-methylpentanamido]-3-methylpentanamido]-4-carbamoylbutanoic acid

C28H42N6O6 (558.3166)


   

Trp Ile Leu Gln

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-3-methylpentanamido]-4-methylpentanamido]-4-carbamoylbutanoic acid

C28H42N6O6 (558.3166)


   

Trp Ile Gln Ile

(2S,3S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-3-methylpentanamido]-4-carbamoylbutanamido]-3-methylpentanoic acid

C28H42N6O6 (558.3166)


   

Trp Ile Gln Leu

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-3-methylpentanamido]-4-carbamoylbutanamido]-4-methylpentanoic acid

C28H42N6O6 (558.3166)


   

Trp Leu Ile Gln

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-4-methylpentanamido]-3-methylpentanamido]-4-carbamoylbutanoic acid

C28H42N6O6 (558.3166)


   

Trp Leu Leu Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-4-methylpentanamido]-4-methylpentanamido]-4-carbamoylbutanoic acid

C28H42N6O6 (558.3166)


   

Trp Leu Gln Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-4-methylpentanamido]-4-carbamoylbutanamido]-3-methylpentanoic acid

C28H42N6O6 (558.3166)


   

Trp Leu Gln Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-4-methylpentanamido]-4-carbamoylbutanamido]-4-methylpentanoic acid

C28H42N6O6 (558.3166)


   

Trp Gln Ile Ile

(2S,3S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-4-carbamoylbutanamido]-3-methylpentanamido]-3-methylpentanoic acid

C28H42N6O6 (558.3166)


   

Trp Gln Ile Leu

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-4-carbamoylbutanamido]-3-methylpentanamido]-4-methylpentanoic acid

C28H42N6O6 (558.3166)


   

Trp Gln Leu Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-4-carbamoylbutanamido]-4-methylpentanamido]-3-methylpentanoic acid

C28H42N6O6 (558.3166)


   

Trp Gln Leu Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-4-carbamoylbutanamido]-4-methylpentanamido]-4-methylpentanoic acid

C28H42N6O6 (558.3166)


   

ARLEA

Ala Arg Leu Glu Ala

C23H42N8O8 (558.3125)


   

PI(O-16:0/0:0)

1-hexadecyl-glycero-3-phospho-(1-myo-inositol)

C25H51O11P (558.3169)


   

LPI O-16:0

1-hexadecyl-glycero-3-phospho-(1-myo-inositol)

C25H51O11P (558.3169)


   

Cucurbitacin C7

25-acetyloxy-3beta,16alpha,20beta-trihydroxy-5beta,19beta-epoxy-cucurbit-6,23-dien-11,22-dione

C32H46O8 (558.3193)


   

2-(2-hydroxyethoxy)ethanol,2-hydroxyethyl prop-2-enoate,5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane,oxepan-2-one

2-(2-hydroxyethoxy)ethanol,2-hydroxyethyl prop-2-enoate,5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane,oxepan-2-one

C27H46N2O10 (558.3152)


   

Ethyl (2E,4S)-4-[((2R)-2-{[N-(tert-butoxycarbonyl)-L-valyl]amino}-2-phenylethanoyl)amino]-5-[(3S)-2-oxopyrrolidin-3-YL]pent-2-enoate

Ethyl (2E,4S)-4-[((2R)-2-{[N-(tert-butoxycarbonyl)-L-valyl]amino}-2-phenylethanoyl)amino]-5-[(3S)-2-oxopyrrolidin-3-YL]pent-2-enoate

C29H42N4O7 (558.3053)


   

[(E,6R)-6-[(2S,9R,10R,13R,14S,16R)-2,16-dihydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl] acetate

[(E,6R)-6-[(2S,9R,10R,13R,14S,16R)-2,16-dihydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl] acetate

C32H46O8 (558.3193)


   

[(2S,3R,4R,5S)-2-[(2R,3S,5S,10R,13S)-2,3-dihydroxy-10,13-dimethyl-6-oxo-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-5-ethyl-4-hydroxy-6-methylheptan-3-yl] hydrogen sulfate

[(2S,3R,4R,5S)-2-[(2R,3S,5S,10R,13S)-2,3-dihydroxy-10,13-dimethyl-6-oxo-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-5-ethyl-4-hydroxy-6-methylheptan-3-yl] hydrogen sulfate

C29H50O8S (558.3226)


   

2-[[3-[(3E)-hexa-3,5-dienoyl]oxy-2-[(11E)-tetradeca-11,13-dienoyl]oxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium

2-[[3-[(3E)-hexa-3,5-dienoyl]oxy-2-[(11E)-tetradeca-11,13-dienoyl]oxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium

C28H49NO8P+ (558.3196)


   

Malyngamide 3

Malyngamide 3

C28H47ClN2O7 (558.3072)


A natural product found in Lyngbya majuscula.

   

23,24-dihydrocucurbitacin E

23,24-dihydrocucurbitacin E

C32H46O8 (558.3193)


A 23,24-dihydrocucurbitacin in which a lanostane skeleton is multi-substituted with hydroxy, methyl and oxo substituents, with unsaturation at positions 1 and 5; a hydroxy function at C-25 is acetylated.

   

rel-12-O-(4Z)-Deca-4-enoylphorbol-13-acetate

rel-12-O-(4Z)-Deca-4-enoylphorbol-13-acetate

C32H46O8 (558.3193)


A natural product found in Pimelea elongata.

   

N-[(4S,7S,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-5-[[4-(2-pyridinyl)phenyl]methyl]-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]butanamide

N-[(4S,7S,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-5-[[4-(2-pyridinyl)phenyl]methyl]-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]butanamide

C33H42N4O4 (558.3206)


   

N-[(5S,6S,9S)-5-methoxy-3,6,9-trimethyl-2-oxo-8-[[4-(2-pyridinyl)phenyl]methyl]-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]butanamide

N-[(5S,6S,9S)-5-methoxy-3,6,9-trimethyl-2-oxo-8-[[4-(2-pyridinyl)phenyl]methyl]-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]butanamide

C33H42N4O4 (558.3206)


   

1-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea

1-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea

C33H42N4O4 (558.3206)


   

1-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea

1-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea

C33H42N4O4 (558.3206)


   

1-[(3S,9R,10R)-9-[(dimethylamino)methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

1-[(3S,9R,10R)-9-[(dimethylamino)methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

C30H43FN4O5 (558.3217)


   

1-[(3S,9R,10R)-9-[(dimethylamino)methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

1-[(3S,9R,10R)-9-[(dimethylamino)methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

C30H43FN4O5 (558.3217)


   

1-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea

1-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea

C33H42N4O4 (558.3206)


   

1-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea

1-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea

C33H42N4O4 (558.3206)


   

1-[(3R,9S,10R)-9-[(dimethylamino)methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

1-[(3R,9S,10R)-9-[(dimethylamino)methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

C30H43FN4O5 (558.3217)


   

N-[(5S,6R,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-[[4-(2-pyridinyl)phenyl]methyl]-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]butanamide

N-[(5S,6R,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-[[4-(2-pyridinyl)phenyl]methyl]-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]butanamide

C33H42N4O4 (558.3206)


   

N-[(5S,6S,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-[[4-(2-pyridinyl)phenyl]methyl]-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]butanamide

N-[(5S,6S,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-[[4-(2-pyridinyl)phenyl]methyl]-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]butanamide

C33H42N4O4 (558.3206)


   

1-[(3S,9R,10S)-9-[(dimethylamino)methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

1-[(3S,9R,10S)-9-[(dimethylamino)methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

C30H43FN4O5 (558.3217)


   

1-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea

1-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea

C33H42N4O4 (558.3206)


   

1-[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea

1-[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea

C33H42N4O4 (558.3206)


   

1-[(3S,9S,10R)-9-[(dimethylamino)methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

1-[(3S,9S,10R)-9-[(dimethylamino)methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

C30H43FN4O5 (558.3217)


   

1-[(3R,9R,10S)-9-[(dimethylamino)methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

1-[(3R,9R,10S)-9-[(dimethylamino)methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

C30H43FN4O5 (558.3217)


   

1-[(3S,9R,10S)-9-[(dimethylamino)methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

1-[(3S,9R,10S)-9-[(dimethylamino)methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

C30H43FN4O5 (558.3217)


   

1-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea

1-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea

C33H42N4O4 (558.3206)


   

1-[(3R,9S,10S)-9-[(dimethylamino)methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

1-[(3R,9S,10S)-9-[(dimethylamino)methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

C30H43FN4O5 (558.3217)


   

1-[(3R,9R,10S)-9-[(dimethylamino)methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

1-[(3R,9R,10S)-9-[(dimethylamino)methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

C30H43FN4O5 (558.3217)


   

1-[(3R,9R,10R)-9-[(dimethylamino)methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

1-[(3R,9R,10R)-9-[(dimethylamino)methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

C30H43FN4O5 (558.3217)


   

1-[(3R,9R,10R)-9-[(dimethylamino)methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

1-[(3R,9R,10R)-9-[(dimethylamino)methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

C30H43FN4O5 (558.3217)


   

1-[(3R,9S,10S)-9-[(dimethylamino)methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

1-[(3R,9S,10S)-9-[(dimethylamino)methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

C30H43FN4O5 (558.3217)


   

1-[(3S,9S,10S)-9-[(dimethylamino)methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

1-[(3S,9S,10S)-9-[(dimethylamino)methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

C30H43FN4O5 (558.3217)


   

1-[(3S,9S,10S)-9-[(dimethylamino)methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

1-[(3S,9S,10S)-9-[(dimethylamino)methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-fluorophenyl)urea

C30H43FN4O5 (558.3217)


   

1-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea

1-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea

C33H42N4O4 (558.3206)


   

N-[(5R,6R,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-[[4-(2-pyridinyl)phenyl]methyl]-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]butanamide

N-[(5R,6R,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-[[4-(2-pyridinyl)phenyl]methyl]-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]butanamide

C33H42N4O4 (558.3206)


   

N-[(5R,6R,9S)-5-methoxy-3,6,9-trimethyl-2-oxo-8-[[4-(2-pyridinyl)phenyl]methyl]-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]butanamide

N-[(5R,6R,9S)-5-methoxy-3,6,9-trimethyl-2-oxo-8-[[4-(2-pyridinyl)phenyl]methyl]-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]butanamide

C33H42N4O4 (558.3206)


   

N-[(5R,6S,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-[[4-(2-pyridinyl)phenyl]methyl]-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]butanamide

N-[(5R,6S,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-[[4-(2-pyridinyl)phenyl]methyl]-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]butanamide

C33H42N4O4 (558.3206)


   

N-[(5S,6R,9S)-5-methoxy-3,6,9-trimethyl-2-oxo-8-[[4-(2-pyridinyl)phenyl]methyl]-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]butanamide

N-[(5S,6R,9S)-5-methoxy-3,6,9-trimethyl-2-oxo-8-[[4-(2-pyridinyl)phenyl]methyl]-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]butanamide

C33H42N4O4 (558.3206)


   
   

2-[[3-butanoyloxy-2-[(4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoyl]oxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium

2-[[3-butanoyloxy-2-[(4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoyl]oxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium

C28H49NO8P+ (558.3196)


   

2-[[3-acetyloxy-2-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyl]oxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium

2-[[3-acetyloxy-2-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyl]oxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium

C28H49NO8P+ (558.3196)


   

Cuc B

(R,E)-6-((2S,8S,9R,10R,13R,14S,16R,17R)-2,16-dihydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl acetate

C32H46O8 (558.3193)


Cucurbitacin B is a cucurbitacin in which a lanostane skeleton is multi-substituted with hydroxy, methyl and oxo substituents, with unsaturation at positions 5 and 23; a hydroxy function at C-25 is acetylated. It is a cucurbitacin, a secondary alpha-hydroxy ketone and a tertiary alpha-hydroxy ketone. It derives from a hydride of a lanostane. Cucurbitacin B is a natural product found in Begonia plebeja, Trichosanthes miyagii, and other organisms with data available. A cucurbitacin in which a lanostane skeleton is multi-substituted with hydroxy, methyl and oxo substituents, with unsaturation at positions 5 and 23; a hydroxy function at C-25 is acetylated. Cucurbitacin B belongs to a class of highly oxidized tetracyclic triterpenoids and is oral active. Cucurbitacin B inhibits tumor cell growth, migration and invasion and cycle arrest, but induces cell apoptosis. Cucurbitacin B has potent anti-inflammatory, antioxidant, antiviral, hypoglycemic, hepatoprotective, neuroprotective activity[1][2][3][4][5]. Cucurbitacin B belongs to a class of highly oxidized tetracyclic triterpenoids and is oral active. Cucurbitacin B inhibits tumor cell growth, migration and invasion and cycle arrest, but induces cell apoptosis. Cucurbitacin B has potent anti-inflammatory, antioxidant, antiviral, hypoglycemic, hepatoprotective, neuroprotective activity[1][2][3][4][5].

   

1-hexadecyl-glycero-3-phospho-(1-myo-inositol)

1-hexadecyl-glycero-3-phospho-(1-myo-inositol)

C25H51O11P (558.3169)


   

ST 26:4;O2;GlcA

ST 26:4;O2;GlcA

C32H46O8 (558.3193)


   

ST 26:5;O3;Hex

ST 26:5;O3;Hex

C32H46O8 (558.3193)


   
   

(2r,6r)-6-[(1r,3ar,4s,5ar,7s,9as,11ar)-7-(acetyloxy)-4-hydroxy-3a,6,6,9a,11a-pentamethyl-3,10-dioxo-1h,2h,4h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methyl-4-oxoheptanoic acid

(2r,6r)-6-[(1r,3ar,4s,5ar,7s,9as,11ar)-7-(acetyloxy)-4-hydroxy-3a,6,6,9a,11a-pentamethyl-3,10-dioxo-1h,2h,4h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methyl-4-oxoheptanoic acid

C32H46O8 (558.3193)


   

(1'r,2r,4's,5s,6r,8'r,10'e,13'r,14'e,16'e,20'r,21'r,24's)-24'-hydroxy-22'-(hydroxymethyl)-21'-methoxy-5,6,11',13'-tetramethyl-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraen-2'-one

(1'r,2r,4's,5s,6r,8'r,10'e,13'r,14'e,16'e,20'r,21'r,24's)-24'-hydroxy-22'-(hydroxymethyl)-21'-methoxy-5,6,11',13'-tetramethyl-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraen-2'-one

C32H46O8 (558.3193)


   

(1s)-1-[(1s,3s)-3-{2-[(1s,2s,4s)-4-hydroxy-1,5,5-trimethyl-3,6-dioxaspiro[bicyclo[2.2.2]octane-2,2'-oxan]-5'-ylidene]ethyl}-2,2-dimethyl-6-methylidenecyclohexyl]-2-(2-oxooxolan-3-ylidene)ethyl acetate

(1s)-1-[(1s,3s)-3-{2-[(1s,2s,4s)-4-hydroxy-1,5,5-trimethyl-3,6-dioxaspiro[bicyclo[2.2.2]octane-2,2'-oxan]-5'-ylidene]ethyl}-2,2-dimethyl-6-methylidenecyclohexyl]-2-(2-oxooxolan-3-ylidene)ethyl acetate

C32H46O8 (558.3193)


   

6-[7-(acetyloxy)-3-hydroxy-3a,6,6,9a,11a-pentamethyl-4,10-dioxo-1h,2h,3h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methyl-4-oxoheptanoic acid

6-[7-(acetyloxy)-3-hydroxy-3a,6,6,9a,11a-pentamethyl-4,10-dioxo-1h,2h,3h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methyl-4-oxoheptanoic acid

C32H46O8 (558.3193)


   

6,10,15,15-tetramethyl-7-[1-(5-methyl-6-oxo-2,3-dihydropyran-2-yl)ethyl]-3,19-dioxo-16,20-dioxatetracyclo[12.6.0.0¹,¹⁷.0⁶,¹⁰]icosan-4-yl acetate

6,10,15,15-tetramethyl-7-[1-(5-methyl-6-oxo-2,3-dihydropyran-2-yl)ethyl]-3,19-dioxo-16,20-dioxatetracyclo[12.6.0.0¹,¹⁷.0⁶,¹⁰]icosan-4-yl acetate

C32H46O8 (558.3193)


   

6-ethyl-21',24'-dihydroxy-22'-(hydroxymethyl)-5,11',13'-trimethyl-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraen-2'-one

6-ethyl-21',24'-dihydroxy-22'-(hydroxymethyl)-5,11',13'-trimethyl-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraen-2'-one

C32H46O8 (558.3193)


   

(1r,2s,3s,4's,6s,8s,9r,11s,12s,13s,15r,17r,18s,20s,21r)-8-(acetyloxy)-4',5',5',11,17-pentamethyl-14,16,19-trioxaspiro[heptacyclo[11.8.1.1²,²⁰.0¹,¹⁵.0³,¹².0⁶,¹¹.0¹⁷,²¹]tricosane-18,2'-oxolan]-9-yl acetate

(1r,2s,3s,4's,6s,8s,9r,11s,12s,13s,15r,17r,18s,20s,21r)-8-(acetyloxy)-4',5',5',11,17-pentamethyl-14,16,19-trioxaspiro[heptacyclo[11.8.1.1²,²⁰.0¹,¹⁵.0³,¹².0⁶,¹¹.0¹⁷,²¹]tricosane-18,2'-oxolan]-9-yl acetate

C32H46O8 (558.3193)


   

(2r)-1-[(1s,2s,3'r,3as,3bs,4r,4'r,9ar,9br,11as)-4-(acetyloxy)-2-hydroxy-3',9a,11a-trimethyl-7-oxo-3,3a,3b,4,5,9b,10,11-octahydro-2h-spiro[cyclopenta[a]phenanthrene-1,2'-oxetan]-4'-yl]-3-hydroxy-2,3-dimethylbutan-2-yl acetate

(2r)-1-[(1s,2s,3'r,3as,3bs,4r,4'r,9ar,9br,11as)-4-(acetyloxy)-2-hydroxy-3',9a,11a-trimethyl-7-oxo-3,3a,3b,4,5,9b,10,11-octahydro-2h-spiro[cyclopenta[a]phenanthrene-1,2'-oxetan]-4'-yl]-3-hydroxy-2,3-dimethylbutan-2-yl acetate

C32H46O8 (558.3193)


   

8-(acetyloxy)-4',5',5',11,17-pentamethyl-14,16,19-trioxaspiro[heptacyclo[11.8.1.1²,²⁰.0¹,¹⁵.0³,¹².0⁶,¹¹.0¹⁷,²¹]tricosane-18,2'-oxolan]-9-yl acetate

8-(acetyloxy)-4',5',5',11,17-pentamethyl-14,16,19-trioxaspiro[heptacyclo[11.8.1.1²,²⁰.0¹,¹⁵.0³,¹².0⁶,¹¹.0¹⁷,²¹]tricosane-18,2'-oxolan]-9-yl acetate

C32H46O8 (558.3193)


   

3-epi-isocucurbitacin b

NA

C32H46O8 (558.3193)


{"Ingredient_id": "HBIN008480","Ingredient_name": "3-epi-isocucurbitacin b ","Alias": "NA","Ingredient_formula": "C32H46O8","Ingredient_Smile": "CC(=O)OC(C)(C)C=CC(=O)C(C)(C1C(CC2(C1(CC(=O)C3(C2CC=C4C3CC(=O)C(C4(C)C)O)C)C)C)O)O","Ingredient_weight": "558.7 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "20939","PubChem_id": "123134757","DrugBank_id": "NA"}

   

(1s,4r,5s,6e,8s,10e,12r,13s,15r,16s,17r,18s)-5,20-dihydroxy-18-(1h-indol-3-ylmethyl)-4-(1-methoxyethenyl)-6,8,15,16-tetramethyl-14-oxa-19-azatetracyclo[10.8.0.0¹,¹⁷.0¹³,¹⁵]icosa-6,10,19-trien-2-one

(1s,4r,5s,6e,8s,10e,12r,13s,15r,16s,17r,18s)-5,20-dihydroxy-18-(1h-indol-3-ylmethyl)-4-(1-methoxyethenyl)-6,8,15,16-tetramethyl-14-oxa-19-azatetracyclo[10.8.0.0¹,¹⁷.0¹³,¹⁵]icosa-6,10,19-trien-2-one

C34H42N2O5 (558.3094)


   

[1-(5-ethyl-6-methylhept-6-en-2-yl)-1,3,7-trihydroxy-11a-(hydroxymethyl)-9a-methyl-tetradecahydrocyclopenta[a]phenanthren-8-yl]oxidanesulfonic acid

[1-(5-ethyl-6-methylhept-6-en-2-yl)-1,3,7-trihydroxy-11a-(hydroxymethyl)-9a-methyl-tetradecahydrocyclopenta[a]phenanthren-8-yl]oxidanesulfonic acid

C29H50O8S (558.3226)


   

(6r)-6-[(1r,3s,3ar,5ar,7s,9as,11ar)-7-(acetyloxy)-3-hydroxy-3a,6,6,9a,11a-pentamethyl-4,10-dioxo-1h,2h,3h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methyl-4-oxoheptanoic acid

(6r)-6-[(1r,3s,3ar,5ar,7s,9as,11ar)-7-(acetyloxy)-3-hydroxy-3a,6,6,9a,11a-pentamethyl-4,10-dioxo-1h,2h,3h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methyl-4-oxoheptanoic acid

C32H46O8 (558.3193)


   

(3e,6r)-6-[(1r,2r,3as,3bs,7r,9ar,9br,11ar)-2,7-dihydroxy-3a,6,6,9b,11a-pentamethyl-8,10-dioxo-1h,2h,3h,3bh,4h,7h,9h,9ah,11h-cyclopenta[a]phenanthren-1-yl]-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl acetate

(3e,6r)-6-[(1r,2r,3as,3bs,7r,9ar,9br,11ar)-2,7-dihydroxy-3a,6,6,9b,11a-pentamethyl-8,10-dioxo-1h,2h,3h,3bh,4h,7h,9h,9ah,11h-cyclopenta[a]phenanthren-1-yl]-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl acetate

C32H46O8 (558.3193)


   

3-{4,10-dihydroxy-3b,6,6,9a,11a-pentamethyl-7-oxo-1h,2h,4h,5h,5ah,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl}-6-hydroxy-7,7-dimethyl-5-oxooxepan-2-yl acetate

3-{4,10-dihydroxy-3b,6,6,9a,11a-pentamethyl-7-oxo-1h,2h,4h,5h,5ah,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl}-6-hydroxy-7,7-dimethyl-5-oxooxepan-2-yl acetate

C32H46O8 (558.3193)


   

(3e,6s)-6-[(1s,2s,3as,3br,8s,9ar,9br,11ar)-2,8-dihydroxy-3a,6,6,9b,11a-pentamethyl-7,10-dioxo-1h,2h,3h,3bh,4h,8h,9h,9ah,11h-cyclopenta[a]phenanthren-1-yl]-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl acetate

(3e,6s)-6-[(1s,2s,3as,3br,8s,9ar,9br,11ar)-2,8-dihydroxy-3a,6,6,9b,11a-pentamethyl-7,10-dioxo-1h,2h,3h,3bh,4h,8h,9h,9ah,11h-cyclopenta[a]phenanthren-1-yl]-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl acetate

C32H46O8 (558.3193)


   

5,20-dihydroxy-18-(1h-indol-3-ylmethyl)-4-(1-methoxyethenyl)-6,8,15,16-tetramethyl-14-oxa-19-azatetracyclo[10.8.0.0¹,¹⁷.0¹³,¹⁵]icosa-6,10,19-trien-2-one

5,20-dihydroxy-18-(1h-indol-3-ylmethyl)-4-(1-methoxyethenyl)-6,8,15,16-tetramethyl-14-oxa-19-azatetracyclo[10.8.0.0¹,¹⁷.0¹³,¹⁵]icosa-6,10,19-trien-2-one

C34H42N2O5 (558.3094)


   

(1'r,2r,4's,5s,6r,8'r,10'e,13'r,14'e,16'e,20'r,21'r,24's)-6,24'-dihydroxy-21'-methoxy-5,6,11',13',22'-pentamethyl-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraen-2'-one

(1'r,2r,4's,5s,6r,8'r,10'e,13'r,14'e,16'e,20'r,21'r,24's)-6,24'-dihydroxy-21'-methoxy-5,6,11',13',22'-pentamethyl-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraen-2'-one

C32H46O8 (558.3193)


   

6-{2,8-dihydroxy-3a,6,6,9b,11a-pentamethyl-7,10-dioxo-1h,2h,3h,3bh,4h,8h,9h,9ah,11h-cyclopenta[a]phenanthren-1-yl}-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl acetate

6-{2,8-dihydroxy-3a,6,6,9b,11a-pentamethyl-7,10-dioxo-1h,2h,3h,3bh,4h,8h,9h,9ah,11h-cyclopenta[a]phenanthren-1-yl}-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl acetate

C32H46O8 (558.3193)


   

(1r,4s,6r,7r,10r,14s,17s)-6,10,15,15-tetramethyl-7-[(1s)-1-[(2r)-5-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-3,19-dioxo-16,20-dioxatetracyclo[12.6.0.0¹,¹⁷.0⁶,¹⁰]icosan-4-yl acetate

(1r,4s,6r,7r,10r,14s,17s)-6,10,15,15-tetramethyl-7-[(1s)-1-[(2r)-5-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-3,19-dioxo-16,20-dioxatetracyclo[12.6.0.0¹,¹⁷.0⁶,¹⁰]icosan-4-yl acetate

C32H46O8 (558.3193)


   

(3e,6s)-6-[(1r,2r,3as,3bs,8r,9ar,9br,11ar)-2,8-dihydroxy-3a,6,6,9b,11a-pentamethyl-7,10-dioxo-1h,2h,3h,3bh,4h,8h,9h,9ah,11h-cyclopenta[a]phenanthren-1-yl]-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl acetate

(3e,6s)-6-[(1r,2r,3as,3bs,8r,9ar,9br,11ar)-2,8-dihydroxy-3a,6,6,9b,11a-pentamethyl-7,10-dioxo-1h,2h,3h,3bh,4h,8h,9h,9ah,11h-cyclopenta[a]phenanthren-1-yl]-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl acetate

C32H46O8 (558.3193)


   

6-{2,8-dihydroxy-3a,6,6,9b,11a-pentamethyl-7,10-dioxo-1h,2h,3h,3bh,4h,9ah,11h-cyclopenta[a]phenanthren-1-yl}-6-hydroxy-2-methyl-5-oxoheptan-2-yl acetate

6-{2,8-dihydroxy-3a,6,6,9b,11a-pentamethyl-7,10-dioxo-1h,2h,3h,3bh,4h,9ah,11h-cyclopenta[a]phenanthren-1-yl}-6-hydroxy-2-methyl-5-oxoheptan-2-yl acetate

C32H46O8 (558.3193)


   

6-[11-(acetyloxy)-4-hydroxy-6-(hydroxymethyl)-3a,6,9a,11a-tetramethyl-7,10-dioxo-1h,2h,3h,4h,5h,5ah,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methylhept-2-enoic acid

6-[11-(acetyloxy)-4-hydroxy-6-(hydroxymethyl)-3a,6,9a,11a-tetramethyl-7,10-dioxo-1h,2h,3h,4h,5h,5ah,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methylhept-2-enoic acid

C32H46O8 (558.3193)


   

6-[11-(acetyloxy)-4,7-dihydroxy-3a,6,6,9a,11a-pentamethyl-3,10-dioxo-1h,2h,4h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methylhept-2-enoic acid

6-[11-(acetyloxy)-4,7-dihydroxy-3a,6,6,9a,11a-pentamethyl-3,10-dioxo-1h,2h,4h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methylhept-2-enoic acid

C32H46O8 (558.3193)


   

5'-(1-{1-ethyl-5,6,6-trimethyl-2,7,8-trioxabicyclo[3.2.1]octan-3-yl}ethyl)-6',10'-dimethyl-5-oxo-13'-oxaspiro[oxolane-2,11'-tetracyclo[7.5.0.0²,⁶.0¹²,¹⁴]tetradecan]-8'-en-7'-yl acetate

5'-(1-{1-ethyl-5,6,6-trimethyl-2,7,8-trioxabicyclo[3.2.1]octan-3-yl}ethyl)-6',10'-dimethyl-5-oxo-13'-oxaspiro[oxolane-2,11'-tetracyclo[7.5.0.0²,⁶.0¹²,¹⁴]tetradecan]-8'-en-7'-yl acetate

C32H46O8 (558.3193)


   

(1s,4r,6r,7r,10r,14s,17r)-6,10,15,15-tetramethyl-7-[(1s)-1-[(2r)-5-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-3,19-dioxo-16,20-dioxatetracyclo[12.6.0.0¹,¹⁷.0⁶,¹⁰]icosan-4-yl acetate

(1s,4r,6r,7r,10r,14s,17r)-6,10,15,15-tetramethyl-7-[(1s)-1-[(2r)-5-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-3,19-dioxo-16,20-dioxatetracyclo[12.6.0.0¹,¹⁷.0⁶,¹⁰]icosan-4-yl acetate

C32H46O8 (558.3193)


   

6-{2,7-dihydroxy-3a,6,6,9b,11a-pentamethyl-8,10-dioxo-1h,2h,3h,3bh,4h,7h,9h,9ah,11h-cyclopenta[a]phenanthren-1-yl}-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl acetate

6-{2,7-dihydroxy-3a,6,6,9b,11a-pentamethyl-8,10-dioxo-1h,2h,3h,3bh,4h,7h,9h,9ah,11h-cyclopenta[a]phenanthren-1-yl}-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl acetate

C32H46O8 (558.3193)


   

(3e,6r)-6-[(2r,3as,3bs,8s,9ar,9br,11ar)-2,8-dihydroxy-3a,6,6,9b,11a-pentamethyl-7,10-dioxo-1h,2h,3h,3bh,4h,8h,9h,9ah,11h-cyclopenta[a]phenanthren-1-yl]-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl acetate

(3e,6r)-6-[(2r,3as,3bs,8s,9ar,9br,11ar)-2,8-dihydroxy-3a,6,6,9b,11a-pentamethyl-7,10-dioxo-1h,2h,3h,3bh,4h,8h,9h,9ah,11h-cyclopenta[a]phenanthren-1-yl]-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl acetate

C32H46O8 (558.3193)


   

(1'r,2r,4's,5s,6r,8'r,10'e,13'r,14'e,16'e,20'r,21'r,24's)-6-ethyl-21',24'-dihydroxy-22'-(hydroxymethyl)-5,11',13'-trimethyl-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraen-2'-one

(1'r,2r,4's,5s,6r,8'r,10'e,13'r,14'e,16'e,20'r,21'r,24's)-6-ethyl-21',24'-dihydroxy-22'-(hydroxymethyl)-5,11',13'-trimethyl-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraen-2'-one

C32H46O8 (558.3193)


   

(1s)-1-[(1s,3r)-2,2-dimethyl-6-methylidene-3-{2-[(1s,5s,5's,6s)-3,3,5-trimethyl-2-oxo-4,7-dioxaspiro[bicyclo[3.2.1]octane-6,2'-oxan]-5'-yl]ethyl}cyclohexyl]-2-(2-oxooxolan-3-ylidene)ethyl acetate

(1s)-1-[(1s,3r)-2,2-dimethyl-6-methylidene-3-{2-[(1s,5s,5's,6s)-3,3,5-trimethyl-2-oxo-4,7-dioxaspiro[bicyclo[3.2.1]octane-6,2'-oxan]-5'-yl]ethyl}cyclohexyl]-2-(2-oxooxolan-3-ylidene)ethyl acetate

C32H46O8 (558.3193)


   

(2s,6r)-6-[(1r,3r,3ar,5ar,6r,9as,11ar)-6-[(acetyloxy)methyl]-3-hydroxy-3a,6,9a,11a-tetramethyl-4,7-dioxo-1h,2h,3h,5h,5ah,8h,9h,10h,11h-cyclopenta[a]phenanthren-1-yl]-2-methyl-4-oxoheptanoic acid

(2s,6r)-6-[(1r,3r,3ar,5ar,6r,9as,11ar)-6-[(acetyloxy)methyl]-3-hydroxy-3a,6,9a,11a-tetramethyl-4,7-dioxo-1h,2h,3h,5h,5ah,8h,9h,10h,11h-cyclopenta[a]phenanthren-1-yl]-2-methyl-4-oxoheptanoic acid

C32H46O8 (558.3193)


   

3-[4-(acetyloxy)-2-hydroxy-3',9a,11a-trimethyl-7-oxo-3,3a,3b,4,5,9b,10,11-octahydro-2h-spiro[cyclopenta[a]phenanthrene-1,2'-oxetan]-4'-ylmethyl]-3-hydroxy-2-methylbutan-2-yl acetate

3-[4-(acetyloxy)-2-hydroxy-3',9a,11a-trimethyl-7-oxo-3,3a,3b,4,5,9b,10,11-octahydro-2h-spiro[cyclopenta[a]phenanthrene-1,2'-oxetan]-4'-ylmethyl]-3-hydroxy-2-methylbutan-2-yl acetate

C32H46O8 (558.3193)


   

(1'r,2r,2'r,5's,6's,7's,10's,12's,14's)-5'-[(1s)-1-[(1s,3r,5r)-1-ethyl-5,6,6-trimethyl-2,7,8-trioxabicyclo[3.2.1]octan-3-yl]ethyl]-6',10'-dimethyl-5-oxo-13'-oxaspiro[oxolane-2,11'-tetracyclo[7.5.0.0²,⁶.0¹²,¹⁴]tetradecan]-8'-en-7'-yl acetate

(1'r,2r,2'r,5's,6's,7's,10's,12's,14's)-5'-[(1s)-1-[(1s,3r,5r)-1-ethyl-5,6,6-trimethyl-2,7,8-trioxabicyclo[3.2.1]octan-3-yl]ethyl]-6',10'-dimethyl-5-oxo-13'-oxaspiro[oxolane-2,11'-tetracyclo[7.5.0.0²,⁶.0¹²,¹⁴]tetradecan]-8'-en-7'-yl acetate

C32H46O8 (558.3193)


   

1-[2,2-dimethyl-6-methylidene-3-(2-{3,3,5-trimethyl-2-oxo-4,7-dioxaspiro[bicyclo[3.2.1]octane-6,2'-oxan]-5'-yl}ethyl)cyclohexyl]-2-(2-oxooxolan-3-ylidene)ethyl acetate

1-[2,2-dimethyl-6-methylidene-3-(2-{3,3,5-trimethyl-2-oxo-4,7-dioxaspiro[bicyclo[3.2.1]octane-6,2'-oxan]-5'-yl}ethyl)cyclohexyl]-2-(2-oxooxolan-3-ylidene)ethyl acetate

C32H46O8 (558.3193)


   

(2s,3as,7as)-n-(5-carbamimidamido-1-oxopentan-2-yl)-6-hydroxy-1-[(2s)-2-[(1-hydroxybutylidene)amino]-3-(4-hydroxyphenyl)propanoyl]-octahydroindole-2-carboximidic acid

(2s,3as,7as)-n-(5-carbamimidamido-1-oxopentan-2-yl)-6-hydroxy-1-[(2s)-2-[(1-hydroxybutylidene)amino]-3-(4-hydroxyphenyl)propanoyl]-octahydroindole-2-carboximidic acid

C28H42N6O6 (558.3166)


   

(1r,4r,6r,7r,10r,14s,17r)-6,10,15,15-tetramethyl-7-[(1s)-1-[(2r)-5-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-3,19-dioxo-16,20-dioxatetracyclo[12.6.0.0¹,¹⁷.0⁶,¹⁰]icosan-4-yl acetate

(1r,4r,6r,7r,10r,14s,17r)-6,10,15,15-tetramethyl-7-[(1s)-1-[(2r)-5-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-3,19-dioxo-16,20-dioxatetracyclo[12.6.0.0¹,¹⁷.0⁶,¹⁰]icosan-4-yl acetate

C32H46O8 (558.3193)


   

(3e,6r)-6-[(1r,2r,3as,3bs,8s,9as,9br,11ar)-2,8-dihydroxy-3a,6,6,9b,11a-pentamethyl-7,10-dioxo-1h,2h,3h,3bh,4h,8h,9h,9ah,11h-cyclopenta[a]phenanthren-1-yl]-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl acetate

(3e,6r)-6-[(1r,2r,3as,3bs,8s,9as,9br,11ar)-2,8-dihydroxy-3a,6,6,9b,11a-pentamethyl-7,10-dioxo-1h,2h,3h,3bh,4h,8h,9h,9ah,11h-cyclopenta[a]phenanthren-1-yl]-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl acetate

C32H46O8 (558.3193)


   

6-chloro-n-(2-hydroxy-4-methoxy-4-oxobutyl)-5-[(7-methoxy-n-methyltetradec-4-enamido)methyl]-3-oxohex-5-enimidic acid

6-chloro-n-(2-hydroxy-4-methoxy-4-oxobutyl)-5-[(7-methoxy-n-methyltetradec-4-enamido)methyl]-3-oxohex-5-enimidic acid

C28H47ClN2O7 (558.3072)


   

(2r,6r)-6-[(1r,3s,3ar,5ar,7s,9as,11ar)-7-(acetyloxy)-3-hydroxy-3a,6,6,9a,11a-pentamethyl-4,10-dioxo-1h,2h,3h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methyl-4-oxoheptanoic acid

(2r,6r)-6-[(1r,3s,3ar,5ar,7s,9as,11ar)-7-(acetyloxy)-3-hydroxy-3a,6,6,9a,11a-pentamethyl-4,10-dioxo-1h,2h,3h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methyl-4-oxoheptanoic acid

C32H46O8 (558.3193)


   

methyl 3-[8'-(acetyloxy)-4-ethyl-1,5',10'-trimethyl-3'-oxo-6'-(prop-1-en-2-yl)-3,7,15'-trioxaspiro[bicyclo[2.2.1]heptane-2,13'-tetracyclo[7.4.2.0¹,¹⁰.0⁴,⁹]pentadecan]-5'-yl]propanoate

methyl 3-[8'-(acetyloxy)-4-ethyl-1,5',10'-trimethyl-3'-oxo-6'-(prop-1-en-2-yl)-3,7,15'-trioxaspiro[bicyclo[2.2.1]heptane-2,13'-tetracyclo[7.4.2.0¹,¹⁰.0⁴,⁹]pentadecan]-5'-yl]propanoate

C32H46O8 (558.3193)


   

(2e,6r)-6-[(1r,3ar,4s,5ar,7s,9as,11s,11ar)-11-(acetyloxy)-4,7-dihydroxy-3a,6,6,9a,11a-pentamethyl-3,10-dioxo-1h,2h,4h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methylhept-2-enoic acid

(2e,6r)-6-[(1r,3ar,4s,5ar,7s,9as,11s,11ar)-11-(acetyloxy)-4,7-dihydroxy-3a,6,6,9a,11a-pentamethyl-3,10-dioxo-1h,2h,4h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methylhept-2-enoic acid

C32H46O8 (558.3193)


   

(5z)-6-chloro-n-[(2r)-2-hydroxy-4-methoxy-4-oxobutyl]-5-{[(4e,7s)-7-methoxy-n-methyltetradec-4-enamido]methyl}-3-oxohex-5-enimidic acid

(5z)-6-chloro-n-[(2r)-2-hydroxy-4-methoxy-4-oxobutyl]-5-{[(4e,7s)-7-methoxy-n-methyltetradec-4-enamido]methyl}-3-oxohex-5-enimidic acid

C28H47ClN2O7 (558.3072)


   

(6r)-6-[(1r,3ar,4s,5ar,7s,9as,11ar)-7-(acetyloxy)-4-hydroxy-3a,6,6,9a,11a-pentamethyl-3,10-dioxo-1h,2h,4h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methyl-4-oxoheptanoic acid

(6r)-6-[(1r,3ar,4s,5ar,7s,9as,11ar)-7-(acetyloxy)-4-hydroxy-3a,6,6,9a,11a-pentamethyl-3,10-dioxo-1h,2h,4h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methyl-4-oxoheptanoic acid

C32H46O8 (558.3193)


   

6-{6-[(acetyloxy)methyl]-3-hydroxy-3a,6,9a,11a-tetramethyl-4,7-dioxo-1h,2h,3h,5h,5ah,8h,9h,10h,11h-cyclopenta[a]phenanthren-1-yl}-2-methyl-4-oxoheptanoic acid

6-{6-[(acetyloxy)methyl]-3-hydroxy-3a,6,9a,11a-tetramethyl-4,7-dioxo-1h,2h,3h,5h,5ah,8h,9h,10h,11h-cyclopenta[a]phenanthren-1-yl}-2-methyl-4-oxoheptanoic acid

C32H46O8 (558.3193)


   

6-[7-(acetyloxy)-4-hydroxy-3a,6,6,9a,11a-pentamethyl-3,10-dioxo-1h,2h,4h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methyl-4-oxoheptanoic acid

6-[7-(acetyloxy)-4-hydroxy-3a,6,6,9a,11a-pentamethyl-3,10-dioxo-1h,2h,4h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methyl-4-oxoheptanoic acid

C32H46O8 (558.3193)


   

21-hexyl-3,9,17-trihydroxy-5-(hydroxymethyl)-8,8,12,24-tetramethyl-13,14,22-trioxapentacyclo[14.6.2.0²,¹².0⁶,⁹.0¹⁹,²³]tetracosa-4,16,18,23-tetraen-15-one

21-hexyl-3,9,17-trihydroxy-5-(hydroxymethyl)-8,8,12,24-tetramethyl-13,14,22-trioxapentacyclo[14.6.2.0²,¹².0⁶,⁹.0¹⁹,²³]tetracosa-4,16,18,23-tetraen-15-one

C32H46O8 (558.3193)


   

methyl 3-[(1s,1's,2r,4s,4'r,5's,6's,8's,9's,10'r)-8'-(acetyloxy)-4-ethyl-1,5',10'-trimethyl-3'-oxo-6'-(prop-1-en-2-yl)-3,7,15'-trioxaspiro[bicyclo[2.2.1]heptane-2,13'-tetracyclo[7.4.2.0¹,¹⁰.0⁴,⁹]pentadecan]-5'-yl]propanoate

methyl 3-[(1s,1's,2r,4s,4'r,5's,6's,8's,9's,10'r)-8'-(acetyloxy)-4-ethyl-1,5',10'-trimethyl-3'-oxo-6'-(prop-1-en-2-yl)-3,7,15'-trioxaspiro[bicyclo[2.2.1]heptane-2,13'-tetracyclo[7.4.2.0¹,¹⁰.0⁴,⁹]pentadecan]-5'-yl]propanoate

C32H46O8 (558.3193)


   

(2e,6r)-6-[(1r,3ar,4s,5ar,6r,9as,11r,11ar)-11-(acetyloxy)-4-hydroxy-6-(hydroxymethyl)-3a,6,9a,11a-tetramethyl-7,10-dioxo-1h,2h,3h,4h,5h,5ah,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methylhept-2-enoic acid

(2e,6r)-6-[(1r,3ar,4s,5ar,6r,9as,11r,11ar)-11-(acetyloxy)-4-hydroxy-6-(hydroxymethyl)-3a,6,9a,11a-tetramethyl-7,10-dioxo-1h,2h,3h,4h,5h,5ah,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methylhept-2-enoic acid

C32H46O8 (558.3193)


   

(3r)-3-[(1s,2s,3'r,3as,3bs,4r,4'r,9ar,9bs,11as)-4-(acetyloxy)-2-hydroxy-3',9a,11a-trimethyl-7-oxo-3,3a,3b,4,5,9b,10,11-octahydro-2h-spiro[cyclopenta[a]phenanthrene-1,2'-oxetan]-4'-ylmethyl]-3-hydroxy-2-methylbutan-2-yl acetate

(3r)-3-[(1s,2s,3'r,3as,3bs,4r,4'r,9ar,9bs,11as)-4-(acetyloxy)-2-hydroxy-3',9a,11a-trimethyl-7-oxo-3,3a,3b,4,5,9b,10,11-octahydro-2h-spiro[cyclopenta[a]phenanthrene-1,2'-oxetan]-4'-ylmethyl]-3-hydroxy-2-methylbutan-2-yl acetate

C32H46O8 (558.3193)


   

(2r,3s,6r)-3-[(1s,3br,4r,5ar,9as,9br,10r,11as)-4,10-dihydroxy-3b,6,6,9a,11a-pentamethyl-7-oxo-1h,2h,4h,5h,5ah,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-6-(2-hydroxypropan-2-yl)-5-oxooxan-2-yl acetate

(2r,3s,6r)-3-[(1s,3br,4r,5ar,9as,9br,10r,11as)-4,10-dihydroxy-3b,6,6,9a,11a-pentamethyl-7-oxo-1h,2h,4h,5h,5ah,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-6-(2-hydroxypropan-2-yl)-5-oxooxan-2-yl acetate

C32H46O8 (558.3193)


   

24'-hydroxy-22'-(hydroxymethyl)-21'-methoxy-5,6,11',13'-tetramethyl-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraen-2'-one

24'-hydroxy-22'-(hydroxymethyl)-21'-methoxy-5,6,11',13'-tetramethyl-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraen-2'-one

C32H46O8 (558.3193)


   

6-chloro-n-[(2r)-2-hydroxy-4-methoxy-4-oxobutyl]-5-{[(4e,7s)-7-methoxy-n-methyltetradec-4-enamido]methyl}-3-oxohex-5-enimidic acid

6-chloro-n-[(2r)-2-hydroxy-4-methoxy-4-oxobutyl]-5-{[(4e,7s)-7-methoxy-n-methyltetradec-4-enamido]methyl}-3-oxohex-5-enimidic acid

C28H47ClN2O7 (558.3072)


   

(3e,6r)-6-[(1r,2r,3as,3bs,7s,9ar,9br,11ar)-2,7-dihydroxy-3a,6,6,9b,11a-pentamethyl-8,10-dioxo-1h,2h,3h,3bh,4h,7h,9h,9ah,11h-cyclopenta[a]phenanthren-1-yl]-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl acetate

(3e,6r)-6-[(1r,2r,3as,3bs,7s,9ar,9br,11ar)-2,7-dihydroxy-3a,6,6,9b,11a-pentamethyl-8,10-dioxo-1h,2h,3h,3bh,4h,7h,9h,9ah,11h-cyclopenta[a]phenanthren-1-yl]-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl acetate

C32H46O8 (558.3193)


   

[(1s,3r,3as,3br,5as,7s,8s,9as,9bs,11as)-1-[(2r,5s)-5-ethyl-6-methylhept-6-en-2-yl]-1,3,7-trihydroxy-11a-(hydroxymethyl)-9a-methyl-tetradecahydrocyclopenta[a]phenanthren-8-yl]oxidanesulfonic acid

[(1s,3r,3as,3br,5as,7s,8s,9as,9bs,11as)-1-[(2r,5s)-5-ethyl-6-methylhept-6-en-2-yl]-1,3,7-trihydroxy-11a-(hydroxymethyl)-9a-methyl-tetradecahydrocyclopenta[a]phenanthren-8-yl]oxidanesulfonic acid

C29H50O8S (558.3226)


   

1-[4-(acetyloxy)-2-hydroxy-3',9a,11a-trimethyl-7-oxo-3,3a,3b,4,5,9b,10,11-octahydro-2h-spiro[cyclopenta[a]phenanthrene-1,2'-oxetan]-4'-yl]-3-hydroxy-2,3-dimethylbutan-2-yl acetate

1-[4-(acetyloxy)-2-hydroxy-3',9a,11a-trimethyl-7-oxo-3,3a,3b,4,5,9b,10,11-octahydro-2h-spiro[cyclopenta[a]phenanthrene-1,2'-oxetan]-4'-yl]-3-hydroxy-2,3-dimethylbutan-2-yl acetate

C32H46O8 (558.3193)


   

(1r,2r,3s,4e,6r,9s,12s,21r)-21-hexyl-3,9,17-trihydroxy-5-(hydroxymethyl)-8,8,12,24-tetramethyl-13,14,22-trioxapentacyclo[14.6.2.0²,¹².0⁶,⁹.0¹⁹,²³]tetracosa-4,16,18,23-tetraen-15-one

(1r,2r,3s,4e,6r,9s,12s,21r)-21-hexyl-3,9,17-trihydroxy-5-(hydroxymethyl)-8,8,12,24-tetramethyl-13,14,22-trioxapentacyclo[14.6.2.0²,¹².0⁶,⁹.0¹⁹,²³]tetracosa-4,16,18,23-tetraen-15-one

C32H46O8 (558.3193)


   

(14'e)-24'-hydroxy-22'-(hydroxymethyl)-21'-methoxy-5,6,11',13'-tetramethyl-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraen-2'-one

(14'e)-24'-hydroxy-22'-(hydroxymethyl)-21'-methoxy-5,6,11',13'-tetramethyl-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraen-2'-one

C32H46O8 (558.3193)


   

1-[3-(2-{4-hydroxy-1,5,5-trimethyl-3,6-dioxaspiro[bicyclo[2.2.2]octane-2,2'-oxan]-5'-ylidene}ethyl)-2,2-dimethyl-6-methylidenecyclohexyl]-2-(2-oxooxolan-3-ylidene)ethyl acetate

1-[3-(2-{4-hydroxy-1,5,5-trimethyl-3,6-dioxaspiro[bicyclo[2.2.2]octane-2,2'-oxan]-5'-ylidene}ethyl)-2,2-dimethyl-6-methylidenecyclohexyl]-2-(2-oxooxolan-3-ylidene)ethyl acetate

C32H46O8 (558.3193)


   

(2r,3r,6s)-3-[(1s,3br,4r,5ar,9as,9br,10r,11as)-4,10-dihydroxy-3b,6,6,9a,11a-pentamethyl-7-oxo-1h,2h,4h,5h,5ah,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-6-hydroxy-7,7-dimethyl-5-oxooxepan-2-yl acetate

(2r,3r,6s)-3-[(1s,3br,4r,5ar,9as,9br,10r,11as)-4,10-dihydroxy-3b,6,6,9a,11a-pentamethyl-7-oxo-1h,2h,4h,5h,5ah,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-6-hydroxy-7,7-dimethyl-5-oxooxepan-2-yl acetate

C32H46O8 (558.3193)


   

(1'r,2s,4's,5s,6r,8'r,10'e,12'r,13's,14'e,16'e,20'r,21'r,24's)-6-ethyl-12',21',24'-trihydroxy-5,11',13',22'-tetramethyl-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraen-2'-one

(1'r,2s,4's,5s,6r,8'r,10'e,12'r,13's,14'e,16'e,20'r,21'r,24's)-6-ethyl-12',21',24'-trihydroxy-5,11',13',22'-tetramethyl-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraen-2'-one

C32H46O8 (558.3193)