Exact Mass: 500.3502
Exact Mass Matches: 500.3502
Found 500 metabolites which its exact mass value is equals to given mass value 500.3502
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Adouetine X
Frangulanine
Frangulanine is found in fruits. Frangulanine is an alkaloid from the root bark of Ceanothus americanus (New Jersey tea), Hovenia dulcis (raisin tree) and Zizyphus jujuba var. inermi
Vicenistatin
D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams
Adouetine X
Adouetine X is found in fruits. Adouetine X is an alkaloid from Ceanothus americanus (New Jersey tea) and Zizyphus jujuba var. inermis. Alkaloid from Ceanothus americanus (New Jersey tea) and Zizyphus jujuba variety inermis. Adouetine X is found in tea and fruits.
5,19-Epoxy-19,25-dimethoxycucurbita-6,23-dien-3-ol
25-hydroxy-3-epidehydrotumulosic acid
A tetracyclic triterpenoid that is lanosta-7,9(11)-dien-21-oic acid substituted by hydroxy groups at positions 3, 16 and 25 and a methylidene group at position 24. It has been isolated from Poria cocos.
3-Ac-(2alpha,3beta,11alpha)-12-Oleanene-2,3,11-triol|3beta-acetoxy-olean-12-ene-2alpha,11alpha-diol
Methyl (24E)-3??,23??-dihydroxy-15-oxo-17,14-friedo-lanostan-8(14),24-dien-26-oate
Me ester-(3beta,16alpha)-3,16-Dihydroxy-23-oxo-12-oleanen-28-oic acid
3beta-acetoxy-12alpha-hydroxyoleanan-28,13beta-olide
Benzoyl-(3S,5E,7E,22E)-9,10-Secoergosta-5,7,10(19),22-tetraen-3-ol
12-O-acetyl-dammar-24-ene-12beta,20(S)-diol-3-one|3-Ketone,12-Ac-Dammar-24-ene-3,12,20-triol
3beta-acetoxy-20alpha,21alpha-epoxytaraxastan-22alpha-ol
3beta-acetoxy-1beta,11alpha-dihydroxy-urs-12-ene|3beta-acetoxy-1beta,11alpha-dihydroxyurs-12-ene|3beta-acetoxy-urs-12-ene-1beta,11alpha-diol
3beta-acetoxy-11alpha-hydroxy-11(12-13)abeooleanan-12-al
methyl (12R,13S)-2alpha,3alpha,24-trihydroxy-12,13-cyclo-taraxer-14-en-28-oate|Methyl (12R,13S)2??,3??,24-trihydroxy-12,13-cyclo-taraxer-14-en-28-oate
14??,15??-Epoxy-3??-hydroxyserratan-21??-ol-3??-O-acetate
28-Methyl-spergulagenat|3beta-Hydroxy-olean-12-en-28,30-disaeure-28-methylester|3beta-hydroxy-olean-12-ene-28,30-dioic acid-28-methyl ester|Serjansaeure
3beta,24-Dihydroxy-11-oxo-Delta12-oleanen-29-saeure-methylester
24S-ethyl-2beta-hydroxy-4,7-diketo-A-norcholest-5-en-2-oic acid ethyl ester
(3beta,4alpha,20alpha)-3-hydroxyolean-12-ene-23,29-dioic acid 29-methyl ester|3beta,4alpha,20alpha-3-hydroxyolean-12-en-23,29-dioic acid 29-methyl ester|aceriphyllic acid K
(20xi)-3beta,15alpha,16alpha-trihydroxy-24-methyllanosta-7,9(11),24(241)-trien-21-oic acid|15alpha-hydroxydehydrotumulosic acid
(2alpha,3beta,4beta,20S)-4-acetoxy-20-(dimethylamino)-3-[(3-methylbut-2-enoyl)amino]-5alpha-pregnan-2-ol|Hookerianamide B
2-(3-hydroxy-3-methylbutyl)-3-hydroxy-6-(1-oxobutyl)-4,8-diprenyl-8beta-H-cis-bicyclo[3.3.1]non-2-en-1,5-dione|garcinielliptone D
3alpha-yl-butanoate-12alpha-hydroxy-20,24-dimethyl-25-norscalar-17-ene-18,24-carbolactone|phyllolactone A
cryptocaryol E
A member of the class of 2-pyranones that is 5,6-dihydro-2H-pyran-2-one substituted by a hydroxy group at position 5 and a 2,4,6,8-tetrahydroxytricosyl group at position 6. It has been isolated from Cryptocarya species.
2-(3-Hydroxy-3-methylbutyl)-5-[14-(3,5-dihydroxyphenyl)tetradecyl]-1,3-benzenediol
(25R)-3alpha-hydroxy-25-methoxy-23-oxomariessia-7,14-dien-26-oic acid
22alpha-hydroxy-3,4-seco-lupa-4(23),20(30)-diene-3,28-dioic acid 3-methyl ester|acanthosessiligenin I
3beta-acetoxy-18alpha,19alpha-epoxylupan-21beta-ol
(3alpha,11alpha)-11-ethoxy-3-hydroxyurs-12-en-24-oic acid|11alpha-ethoxy-beta-boswellic acid
(20zeta)-3-oxo-16alpha,25-dihydroxy-24-methyllanosta-8,24(24)-dien-21-oic acid|16alpha,25-dihydroxyeburiconic acid
(2Z)-2-{(1RS,5R,6R,10S)-1,10-dihydroxy-6-(3-hydroxypropyl)-10-methyl-3-{(1E,3E)-2-methyl-4-[(5S)-2,5,6,6-tetramethylcyclohex-1-en-1-yl]buta-1,3-dienyl}-2-oxaspiro[4.5]dec-7-ylidene}propanal|hoogianal
methyl 2alpha,3alpha,24-trihydroxyursa-12,20(30)-dien-28-oate|Methyl 2??,3??,24-trihydroxyursa-12,20(30)-dien-28-oate
(3alpha,15alpha,24E)-26-Ac-Dammara-12,24-diene-3,15,26-triol
3beta-acetoxy-21alpha, 22alpha-epoxy-20alpha-hydroxy-20(30)-dihydrotaraxasterol|3beta-acetoxy-21alpha,22alpha-epoxy-20alpha-hydroxy-20(30)-dihydrotaraxasterol|3beta-acetoxy-21alpha,22alpha-epoxytaraxastan-20alpha-ol
16alpha-hydroxy-3,4-seco-24-methyllanosta-4(28),8,24(241)-triene-3,21-dioic acid (20R)|poricoic acid H
(E)-N-[(20S)-4beta-(acetyloxy)20-(dimethylamino)-2beta-hydroxy-5alpha-pregn-14-en-3beta-yl]-2-methylbut-2-enamide|Salignenamide C
ergosterol benzoate|Ergosterolbenzoat|Ergosterylbenzoat
25-Me ether-Stichopogenin A4|Holotoxinogenin-25-methylaether
18alpha-Hydroxy-glycyrrhetinsaeure-methylester|Methyl 18??-hydroxyglycyrrhetate
15alpha,26-dihydroxy-3-oxo-24-methylenelanosta-8-en-21-oic acid|fomefficinic acid F
(23E)-3beta-hydroxy-7beta,25-dimethoxycucurbita-5,23-dien-19-al
Me ester-2,3,23-Trihydroxy-12,18-ursadien-28-oic acid
22-Ac-(3alpha,22S,23E)-Lanosta-8,23-diene-3,22,25-triol
2,3-O-isopropylidenyl-2alpha,3alpha,19alpha-trihydroxyurs-12-en-28-oic acid
methyl 2alpha,3alpha,24-trihydroxyoleana-11,13(18)-dien-28-oate|Methyl 2??,3??,24-trihydroxyoleana-11,13(18)-dien-28-oate
5alpha,6alpha-epoxy-cholest-8-ene-3beta,7alpha-diol 3,7-diacetate|Melithasterol A Diacetate
3beta-acetoxy-16alpha-hydroxy-13beta,28-epoxyoleanane
methyl (13S,14R)-2alpha,3alpha,24-trihydroxy-13,14-cyclo-olean-11-en-28-oate|Methyl (13S,14R)2??,3??,24-trihydroxy-13,14-cyclo-oleana-11-en-28-oate
Me ester-19alpha-19,29-Dihydroxy-3-oxo-12-oleanen-28-oic acid|methyl-19alpha-hydroxyoleanonate
5alpha,6alpha-epoxycholest-8(14)-ene-3beta,7alpha-diol 3,7-diacetate
(19R,23E)-5b,19-Epoxy19-ethoxycucurbita-6,23-diene-3b,25-diol
Ala Arg Arg Val
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Ala Val Arg Arg
Gly Ile Arg Arg
Gly Leu Arg Arg
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Ile Ile Lys Lys
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Ile Ile Gln Lys
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Ile Lys Lys Ile
Ile Lys Lys Leu
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Ile Lys Leu Gln
Ile Lys Gln Ile
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Ile Leu Lys Gln
Ile Leu Gln Lys
Ile Gln Ile Lys
Ile Gln Lys Ile
Ile Gln Lys Leu
Ile Gln Leu Lys
Ile Arg Gly Arg
Ile Arg Arg Gly
Lys Ile Ile Lys
Lys Ile Ile Gln
Lys Ile Lys Ile
Lys Ile Lys Leu
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Lys Ile Gln Ile
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Lys Leu Lys Ile
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Lys Leu Gln Leu
Lys Gln Ile Ile
Lys Gln Ile Leu
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Leu Gly Arg Arg
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Leu Gln Lys Ile
Leu Gln Lys Leu
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Leu Arg Arg Gly
Gln Ile Ile Lys
Gln Ile Lys Ile
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Gln Leu Ile Lys
Gln Leu Lys Ile
Gln Leu Lys Leu
Gln Leu Leu Lys
Arg Ala Arg Val
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Arg Gly Ile Arg
Arg Gly Leu Arg
Arg Gly Arg Ile
Arg Gly Arg Leu
Arg Ile Gly Arg
Arg Ile Arg Gly
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Arg Leu Arg Gly
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Arg Arg Gly Ile
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(1,1-Bis(4-diethylaminophenyl)-4,4-diphenyl-1,3-butadiene)
[(2R,3R,4R,5R)-2-[(1S,2S,3R,4S,6R)-4,6-bis(azaniumyl)-3-[(2R,3R,4R,5S,6R)-3-azaniumyl-6-[(1R)-1-azaniumylethyl]-4,5-dihydroxyoxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-3,5-dihydroxy-5-methyloxan-4-yl]-methylazanium
[3-carboxy-2-[(6E,9E,12E,15E,18E,21E)-tetracosa-6,9,12,15,18,21-hexaenoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(7E,9E,12E,15E,18E,21E)-tetracosa-7,9,12,15,18,21-hexaenoyl]oxypropyl]-trimethylazanium
[3-Carboxy-2-[7-[3-hydroxy-2-(3-hydroxyoctyl)-5-oxocyclopentyl]heptanoyloxy]propyl]-trimethylazanium
[3-carboxy-2-[(E)-7-[3,5-dihydroxy-2-(3-hydroxyoctyl)cyclopentyl]hept-5-enoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(4E,7E,10E,12E,16E)-18-(3-ethylcyclopropen-1-yl)-14-hydroxyoctadeca-4,7,10,12,16-pentaenoyl]oxypropyl]-trimethylazanium
(2S,3S)-2-(dimethylamino)-N-[(2Z,6S,9S,10S)-6-isobutyl-10-isopropyl-5,8-dioxo-11-oxa-4,7-diazabicyclo[10.2.2]hexadeca-1(14),2,12,15-tetraen-9-yl]-3-methyl-pentanamide
Pisonolic acid
A pentacyclic triterpenoid that is the 23-monomethyl ester of gypsogenic acid. It has been isolated from Pisonia aculeata.
1-cyclohexyl-3-[(4S,7S,8S)-5-(cyclopropylmethyl)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea
1-cyclohexyl-3-[(4S,7R,8R)-5-(cyclopropylmethyl)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea
1-cyclohexyl-3-[(4S,7R,8S)-5-(cyclopropylmethyl)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea
1-cyclohexyl-3-[(2R,3R)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]urea
1-cyclohexyl-3-[(4R,7R,8S)-5-(cyclopropylmethyl)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea
1-cyclohexyl-3-[(4R,7R,8R)-5-(cyclopropylmethyl)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea
1-cyclohexyl-3-[(4R,7S,8S)-5-(cyclopropylmethyl)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea
1-cyclohexyl-3-[(4S,7S,8R)-5-(cyclopropylmethyl)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea
1-cyclohexyl-3-[(4R,7S,8R)-5-(cyclopropylmethyl)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea
[1-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoxy]-3-hydroxypropan-2-yl] heptanoate
[1-[(8Z,11Z,14Z,17Z,20Z,23Z)-hexacosa-8,11,14,17,20,23-hexaenoxy]-3-hydroxypropan-2-yl] propanoate
[1-hydroxy-3-[(6Z,9Z,12Z,15Z,18Z,21Z)-tetracosa-6,9,12,15,18,21-hexaenoxy]propan-2-yl] pentanoate
(1-hexanoyloxy-3-hydroxypropan-2-yl) (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate
[2-[(3E,6E,9E)-dodeca-3,6,9-trienoyl]oxy-3-hydroxypropyl] (9E,11E,13E)-hexadeca-9,11,13-trienoate
[2-[(6E,9E)-dodeca-6,9-dienoyl]oxy-3-hydroxypropyl] (7E,9E,11E,13E)-hexadeca-7,9,11,13-tetraenoate
[2-[(E)-dodec-5-enoyl]oxy-3-hydroxypropyl] (5E,7E,9E,11E,13E)-hexadeca-5,7,9,11,13-pentaenoate
[3-[3-butanoyloxy-2-[(Z)-tridec-9-enoyl]oxypropoxy]-1-carboxypropyl]-trimethylazanium
[1-carboxy-3-[3-propanoyloxy-2-[(Z)-tetradec-9-enoyl]oxypropoxy]propyl]-trimethylazanium
[3-[3-acetyloxy-2-[(Z)-pentadec-9-enoyl]oxypropoxy]-1-carboxypropyl]-trimethylazanium
2-[hydroxy-[2-hydroxy-3-[(3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenoxy]propoxy]phosphoryl]oxyethyl-trimethylazanium
2-[carboxy-[3-[(9Z,12Z)-heptadeca-9,12-dienoyl]oxy-2-hydroxypropoxy]methoxy]ethyl-trimethylazanium
(25S)-5alpha-cholestan-3beta,4beta,6alpha,7beta,8beta,15alpha,16beta,26-octol
(25S)-5alpha-cholestan-3beta,4beta,6alpha,7alpha,8beta,15beta,16beta,26-octol
(3e,5e,10e,13e,15e)-8-{[(2r,4s,5s,6r)-4-hydroxy-6-methyl-5-(methylamino)oxan-2-yl]oxy}-7,11,13,19-tetramethyl-1-azacycloicosa-1,3,5,10,13,15-hexaen-2-ol
(2r)-2-[(1s,3r,3ar,6s,7s,9br)-1-hydroxy-6-(3-methoxy-3-oxopropyl)-3a,6,9b-trimethyl-7-(prop-1-en-2-yl)-1h,2h,3h,4h,5h,7h,8h,9h-cyclopenta[a]naphthalen-3-yl]-6-methylhept-5-enoic acid
(2s,3r)-n-[(3s,4s,7s,10z)-5,8-dihydroxy-3-isopropyl-7-(2-methylpropyl)-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),5,8,10,12,15-hexaen-4-yl]-2-(dimethylamino)-3-methylpentanimidic acid
4,6-dihydroxy-7,12,16-trimethyl-15-(6-methyl-5-methylidene-4-oxoheptan-2-yl)pentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadecane-7-carboxylic acid
(2s)-n-[(3s,4r,7r,10z)-5,8-dihydroxy-3-isopropyl-7-(2-methylpropyl)-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),5,8,10,12,15-hexaen-4-yl]-2-(dimethylamino)-4-methylpentanimidic acid
(2r)-2-[(2r,3r,3ar,6s,9br)-6-(2-carboxyethyl)-2-hydroxy-3a,6,9b-trimethyl-7-(prop-1-en-2-yl)-1h,2h,3h,4h,5h,7h,8h,9h-cyclopenta[a]naphthalen-3-yl]-6-methyl-5-methylideneheptanoic acid
(2r,4s,6s)-4,6-dihydroxy-1-[(2s,4s)-4-hydroxy-6-oxooxan-2-yl]henicosan-2-yl acetate
5-(acetyloxy)-2,16-dimethyl-15-(6-methylheptan-2-yl)-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadec-1(11)-en-10-yl acetate
(3e,5e,10e,13e,15e)-8-{[4-hydroxy-6-methyl-5-(methylamino)oxan-2-yl]oxy}-7,11,13,19-tetramethyl-1-azacycloicosa-1,3,5,10,13,15-hexaen-2-ol
methyl 3-[7-(2-hydroxypropan-2-yl)-3a,6,9b-trimethyl-3-[1-(5-methyl-6-oxo-2,3-dihydropyran-2-yl)ethyl]-1h,2h,3h,4h,5h,7h,8h,9h-cyclopenta[a]naphthalen-6-yl]propanoate
2-[7-(acetyloxy)-6,9a,11a-trimethyl-1h,2h,3h,3ah,5h,5ah,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-3-hydroxy-6-methyl-5-methylideneheptanoic acid
methyl 6-hydroxy-2-{2-hydroxy-3a,6,6,9a,11a-pentamethyl-7-oxo-1h,2h,3h,5h,5ah,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl}-6-methylhept-4-enoate
(1s,3r,3ar,3br,5ar,6s,7s,9ar,9br,11as)-1-hydroxy-6-(3-methoxy-3-oxopropyl)-6,9a,9b-trimethyl-3,7-bis(prop-1-en-2-yl)-dodecahydro-1h-cyclopenta[a]phenanthrene-11a-carboxylic acid
methyl 4,6,10-trihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,7,8,8a,10,11,12,12b-dodecahydropicene-4a-carboxylate
1-(5,6-dimethyloct-3-en-2-yl)-3a,7-dihydroxy-9a,11a-dimethyl-5-oxo-1h,2h,3h,5ah,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-8-yl acetate
(2s,3s)-n-[(3r,4s,7s,10e)-5,8-dihydroxy-3-isopropyl-7-(2-methylpropyl)-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),5,8,10,12,15-hexaen-4-yl]-2-(dimethylamino)-3-methylpentanimidic acid
2-[(1r,2s,3r,3ar,5ar,7s,9as,11ar)-2,3,7-trihydroxy-3a,6,6,9a,11a-pentamethyl-1h,2h,3h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-6-methyl-5-methylideneheptanoic acid
(2r,5s,7r,9s,10s,12r,15r,16r)-5-(acetyloxy)-2,16-dimethyl-15-[(2r)-6-methylheptan-2-yl]-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadec-1(11)-en-10-yl acetate
methyl (2r)-2-[(1s,2s,3as,5ar,6s,9ar,9br,11as)-2-hydroxy-6-(hydroxymethyl)-3a,6,9a,11a-tetramethyl-7-oxo-1h,2h,3h,5h,5ah,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-6-methylhept-5-enoate
methyl 3-[(3r,3ar,6s,7r,9br)-7-(2-hydroxypropan-2-yl)-3a,6,9b-trimethyl-3-[(1s)-1-[(2r)-5-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-1h,2h,3h,4h,5h,7h,8h,9h-cyclopenta[a]naphthalen-6-yl]propanoate
(1r,3as,3bs,5r,5ar,9ar,9bs,10r,11ar)-5a,10-dihydroxy-9a,11a-dimethyl-1-[(1r)-1-[(1s,2r)-2-[(2r)-3-methylbutan-2-yl]cyclopropyl]ethyl]-9-oxo-1h,2h,3h,3ah,3bh,4h,5h,6h,9bh,10h,11h-cyclopenta[a]phenanthren-5-yl acetate
11-[(16e)-octadec-16-en-1-yl]-11h-5,10-dioxatetraphen-12-one
(3e,5e,7s,8s,10e,13e,15e,19s)-8-{[(2r,4s,5s,6r)-4-hydroxy-6-methyl-5-(methylamino)oxan-2-yl]oxy}-7,11,13,19-tetramethyl-1-azacycloicosa-1,3,5,10,13,15-hexaen-2-ol
ethyl (1s,2r,4s,9s,10s,13r,14r)-13-[(2r,5s)-5-ethyl-6-methylheptan-2-yl]-4-hydroxy-2,14-dimethyl-5,8-dioxotetracyclo[7.7.0.0²,⁶.0¹⁰,¹⁴]hexadec-6-ene-4-carboxylate
2-[6-(2-carboxyethyl)-2-hydroxy-3a,6,9b-trimethyl-7-(prop-1-en-2-yl)-1h,2h,3h,4h,5h,7h,8h,9h-cyclopenta[a]naphthalen-3-yl]-6-methyl-5-methylideneheptanoic acid
18658-41-8
{"Ingredient_id": "HBIN002080","Ingredient_name": "18658-41-8","Alias": "(2S,3R)-2-dimethylamino-N-[(3S,4S,7S,10Z)-7-isobutyl-3-isopropyl-5,8-dioxo-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(15),10,12(16),13-tetraen-4-yl]-3-methyl-pentanamide; (2S,3R)-2-dimethylamino-N-[(3S,4S,7S,10Z)-7-isobutyl-3-isopropyl-5,8-diketo-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(15),10,12(16),13-tetraen-4-yl]-3-methyl-valeramide; Pentanamide, 2-(dimethylamino)-3-methyl-N-(3-(1-methylethyl)-7-(2-methylpropyl)-5,8-dioxo-2-oxa-6,9-diazabicyclo(10.2.2)hexadeca-10,12,14,15-tetraen-4-yl)-, (3R-(3R*,4S*(2S*,3S*),7S*))-; (2S,3R)-2-dimethylamino-N-[(3S,4S,7S,10Z)-7-isobutyl-3-isopropyl-5,8-dioxo-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(15),10,12(16),13-tetraen-4-yl]-3-methylpentanamide; (2S,3R)-2-dimethylamino-3-methyl-N-[(3S,4S,7S,10Z)-7-(2-methylpropyl)-5,8-dioxo-3-propan-2-yl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(15),10,12(16),13-tetraen-4-yl]pentanamide","Ingredient_formula": "C28H44N4O4","Ingredient_Smile": "CCC(C)C(C(=O)NC1C(OC2=CC=C(C=C2)C=CNC(=O)C(NC1=O)CC(C)C)C(C)C)N(C)C","Ingredient_weight": "500.67","OB_score": "21.52831305","CAS_id": "18658-41-8","SymMap_id": "SMIT13671","TCMID_id": "NA","TCMSP_id": "MOL012956","TCM_ID_id": "NA","PubChem_id": "6450252","DrugBank_id": "NA"}
29-hydroxydehydrotumulosic acid
{"Ingredient_id": "HBIN005094","Ingredient_name": "29-hydroxydehydrotumulosic acid","Alias": "NA","Ingredient_formula": "C31H48O5","Ingredient_Smile": "CC(C)C(=C)CCC(C1C(CC2(C1(CC=C3C2=CCC4C3(CCC(C4(C)CO)O)C)C)C)O)C(=O)O","Ingredient_weight": "500.7 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "35874","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "56838283","DrugBank_id": "NA"}
acerinol; 25-me ether
{"Ingredient_id": "HBIN014371","Ingredient_name": "acerinol; 25-me ether","Alias": "NA","Ingredient_formula": "C31H48O5","Ingredient_Smile": "NA","Ingredient_weight": "500.71","OB_score": "NA","CAS_id": "59665-58-6","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7239","PubChem_id": "NA","DrugBank_id": "NA"}