Exact Mass: 558.3417
Exact Mass Matches: 558.3417
Found 500 metabolites which its exact mass value is equals to given mass value 558.3417
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Cucurbitacin B
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).
Milbemycin beta2
Isocucurbitacin B
Isocucurbitacin B is a natural product found in Helicteres isora, Cucurbita foetidissima, and other organisms with data available.
Colossolactone VII
A tricyclic triterpenoid that is 3,4-seco-lanosta-8,24-diene-26,22-olide 3-methylester substituted by an acetoxy group at position 19 and a hydroxy group at position 4. It is isolated from the fruiting bodies of the Vietnamese mushroom Ganoderma colossum and displays inhibitory activity towards the enzyme HIV protease.
Gamabufotalin-3-hemisuberat|Gamabufotalin-3-suberate|Korksaeure-mono-(3-gamabufotalylester)|Korksaeure-mono-3-gamabufotalylester
7,23-dihydroxy-3-O-malonylcucurbita-5,24-dien-19-al
Petuniasterone C 22-O-<(methylthio)-carbonyl>acetate|Petuniasterone C 22-O-[(methylthio)-carbonyl]acetate|petuniasterone C-22-O-[(methylthio)carbonyl]-acetate
petuniasterone A|petuniasterone A ( 22,24,25-<(methylthio)carbonyl>orthoacetate of (22R,24R)-7alpha-22,24,25-tetrahydroxyergosta-1,4-dien-3-one )
12beta-acetoxy-3beta,7beta-dihydroxy-11,15-dioxo-lanosta-8,24(E)-dien-26-oic acid|ganoderic acid GS-3
3-beta-benzoyloxyoleana-11,13(18)-dien-28-oic acid
3beta-acetoxy-12beta-methoxy-22,25-oxido-7,8-dihydroholothurinogenin
(3beta,15alpha)-3-(acetyloxy)-15-hydroxy-7,11,23-trioxolanost-8-en-26-oic acid|3-O-acetylganoderic acid K
(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
Cucurbitacin B
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].
ent-16-acetoxy-15-hydroxy-7-hydroperoxypimar-8(14)-en-3-yl beta-glucopyranoside
7alpha-acetoxy-21R?,23R?-epoxy-24S?,25-dihydroxy-21alpha-methoxy-4,4,8-trimethyl-cholesta-1,14-dien-3-one|brujavanone H
ent-16-acetoxy-15-hydroxy-14-hydroperoxypimar-7-en-3-yl beta-glucopyranoside
(3beta,7beta)-3-(acetyloxy)-7-hydroxy-11,15,23-trioxolanost-8-en-26-oic acid|3-O-acetylganoderic acid B
His Lys Phe Lys
Phe Lys His Lys
Asp Ile Arg Arg
Asp Leu Arg Arg
Asp Arg Ile Arg
Asp Arg Leu Arg
Asp Arg Arg Ile
Asp Arg Arg Leu
Glu Arg Arg Val
Glu Arg Val Arg
Glu Val Arg Arg
Phe His Lys Lys
Phe Lys Lys His
His Phe Lys Lys
His Lys Lys Phe
Ile Asp Arg Arg
Ile Ile Lys Trp
Ile Ile Gln Trp
Ile Ile Trp Lys
Ile Ile Trp Gln
Ile Lys Ile Trp
Ile Lys Leu Trp
Ile Lys Trp Ile
Ile Lys Trp Leu
Ile Leu Lys Trp
Ile Leu Gln Trp
Ile Leu Trp Lys
Ile Leu Trp Gln
Ile Gln Ile Trp
Ile Gln Leu Trp
Ile Gln Trp Ile
Ile Gln Trp Leu
Ile Arg Asp Arg
Ile Arg Arg Asp
Ile Trp Ile Lys
Ile Trp Ile Gln
Ile Trp Lys Ile
Ile Trp Lys Leu
Ile Trp Leu Lys
Ile Trp Leu Gln
Ile Trp Gln Ile
Ile Trp Gln Leu
Lys Phe His Lys
Lys Phe Lys His
Lys His Phe Lys
Lys His Lys Phe
Lys Ile Ile Trp
Lys Ile Leu Trp
Lys Ile Trp Ile
Lys Ile Trp Leu
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Lys Lys His Phe
Lys Lys Gln Arg
Lys Lys Arg Gln
Lys Leu Ile Trp
Lys Leu Leu Trp
Lys Leu Trp Ile
Lys Leu Trp Leu
Lys Gln Lys Arg
Lys Gln Gln Arg
Lys Gln Arg Lys
Lys Gln Arg Gln
Lys Arg Lys Gln
Lys Arg Gln Lys
Lys Arg Gln Gln
Lys Trp Ile Ile
Lys Trp Ile Leu
Lys Trp Leu Ile
Lys Trp Leu Leu
Leu Asp Arg Arg
Leu Ile Lys Trp
Leu Ile Gln Trp
Leu Ile Trp Lys
Leu Ile Trp Gln
Leu Lys Ile Trp
Leu Lys Leu Trp
Leu Lys Trp Ile
Leu Lys Trp Leu
Leu Leu Lys Trp
Leu Leu Gln Trp
Leu Leu Trp Lys
Leu Leu Trp Gln
Leu Gln Ile Trp
Leu Gln Leu Trp
Leu Gln Trp Ile
Leu Gln Trp Leu
Leu Arg Asp Arg
Leu Arg Arg Asp
Leu Trp Ile Lys
Leu Trp Ile Gln
Leu Trp Lys Ile
Leu Trp Lys Leu
Leu Trp Leu Lys
Leu Trp Leu Gln
Leu Trp Gln Ile
Leu Trp Gln Leu
Met Pro Arg Arg
Met Arg Pro Arg
Met Arg Arg Pro
Pro Met Arg Arg
Pro Arg Met Arg
Pro Arg Arg Met
Gln Ile Ile Trp
Gln Ile Leu Trp
Gln Ile Trp Ile
Gln Ile Trp Leu
Gln Lys Lys Arg
Gln Lys Gln Arg
Gln Lys Arg Lys
Gln Lys Arg Gln
Gln Leu Ile Trp
Gln Leu Leu Trp
Gln Leu Trp Ile
Gln Leu Trp Leu
Gln Gln Lys Arg
Gln Gln Arg Lys
Gln Arg Lys Lys
Gln Arg Lys Gln
Gln Arg Gln Lys
Gln Trp Ile Ile
Gln Trp Ile Leu
Gln Trp Leu Ile
Gln Trp Leu Leu
Arg Asp Ile Arg
Arg Asp Leu Arg
Arg Asp Arg Ile
Arg Asp Arg Leu
Arg Glu Arg Val
Arg Glu Val Arg
Arg Ile Asp Arg
Arg Ile Arg Asp
Arg Lys Lys Gln
Arg Lys Gln Lys
Arg Lys Gln Gln
Arg Leu Asp Arg
Arg Leu Arg Asp
Arg Met Pro Arg
Arg Met Arg Pro
Arg Pro Met Arg
Arg Pro Arg Met
Arg Gln Lys Lys
Arg Gln Lys Gln
Arg Gln Gln Lys
Arg Arg Asp Ile
Arg Arg Asp Leu
Arg Arg Glu Val
Arg Arg Ile Asp
Arg Arg Leu Asp
Arg Arg Met Pro
Arg Arg Pro Met
Arg Arg Val Glu
Arg Val Glu Arg
Arg Val Arg Glu
Arg Val Val Trp
Arg Val Trp Val
Arg Trp Val Val
Val Glu Arg Arg
Val Arg Glu Arg
Val Arg Arg Glu
Val Arg Val Trp
Val Arg Trp Val
Val Val Arg Trp
Val Val Trp Arg
Val Trp Arg Val
Val Trp Val Arg
Trp Ile Ile Lys
Trp Ile Ile Gln
Trp Ile Lys Ile
Trp Ile Lys Leu
Trp Ile Leu Lys
Trp Ile Leu Gln
Trp Ile Gln Ile
Trp Ile Gln Leu
Trp Lys Ile Ile
Trp Lys Ile Leu
Trp Lys Leu Ile
Trp Lys Leu Leu
Trp Leu Ile Lys
Trp Leu Ile Gln
Trp Leu Lys Ile
Trp Leu Lys Leu
Trp Leu Leu Lys
Trp Leu Leu Gln
Trp Leu Gln Ile
Trp Leu Gln Leu
Trp Gln Ile Ile
Trp Gln Ile Leu
Trp Gln Leu Ile
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Trp Arg Val Val
Trp Val Arg Val
Trp Val Val Arg
3-O-alpha-L-rhamnopyranosyl-3-hydroxy-5Z-tetradecenoyl-3-hydroxydecanoic acid
Cucurbitacin C7
2-benzofuran-1,3-dione,2,2-bis(hydroxymethyl)propane-1,3-diol,2,3-dihydroxypropyl dodecanoate
(s)-4-[(1-methylheptyloxy)carbonyl]phenyl 4-octyloxy-4-biphenylcarboxylate
N-[[5-[bis(diethylamino)phosphanyl]-9,9-dimethylxanthen-4-yl]-(diethylamino)phosphanyl]-N-ethylethanamine
2-(2-hydroxyethoxy)ethanol,2-hydroxyethyl prop-2-enoate,5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane,oxepan-2-one
(R)-4-[(1-METHYLHEPTYLOXY)CARBONYL]PHENYL 4-OCTYLOXY-4-BIPHENYLCARBOXYLATE
(R)-3,3-bis(4-tert-butylphenyl)-5,5,6,6,7,7,8,8-octahydro-1,1-binaphthyl-2,2-diol
7-Demethoxyegonol-9(Z),12(Z)Linoleate
A fatty acid ester that is egonol-9(Z),12(Z)linoleate in which the methoxy group at position 7 is replaced by a hydrogen. Isolated from the fruits of Styrax agrestis, it exhibits inhibitory activity against acetylcholinesterase.
Ethyl (2E,4S)-4-[((2R)-2-{[N-(tert-butoxycarbonyl)-L-valyl]amino}-2-phenylethanoyl)amino]-5-[(3S)-2-oxopyrrolidin-3-YL]pent-2-enoate
[(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
2,3-dimethyl-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,3,4-trimethylphenyl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]benzoic acid
[(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
(10E,12Z,16E)-6-ethyl-9-hydroxy-10-(hydroxymethyl)-7-methoxy-5,6,14,16-tetramethylspiro[2,20-dioxatricyclo[17.3.1.04,9]tricosa-5,10,12,16-tetraene-21,2-oxane]-3-one
2-[[3-[(3E)-hexa-3,5-dienoyl]oxy-2-[(11E)-tetradeca-11,13-dienoyl]oxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium
23,24-dihydrocucurbitacin E
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
A natural product found in Pimelea elongata.
methyl 3-[(3aR,6R,7R,9bR)-6-[(acetyloxy)methyl]-7-(2-hydroxypropan-2-yl)-3a,9b-dimethyl-3-{(1S)-1-[(2R)-5-methyl-6-oxo-3,6-dihydro-2H-pyran-2-yl]ethyl}-2,3,3a,4,5,6,7,8,9,9b-decahydro-1H-cyclopenta[a]naphthalen-6-yl]propanoate
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-[(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
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,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-[(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-[(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-[(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-[(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-[(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
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,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
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-[(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,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-[(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-[(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-[(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-[(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-[(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,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,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-[(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-[(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-[(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-[(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-[(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
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,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,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,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
2-[[(2R)-3-[(6Z,9Z,12Z,15Z)-henicosa-6,9,12,15-tetraenoyl]oxy-2-hydroxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium
[(4E,8E,12E)-3-hydroxy-2-(nonanoylamino)pentadeca-4,8,12-trienyl] 2-(trimethylazaniumyl)ethyl phosphate
[(4E,8E,12E)-3-hydroxy-2-(octanoylamino)hexadeca-4,8,12-trienyl] 2-(trimethylazaniumyl)ethyl phosphate
[(4E,8E,12E)-2-acetamido-3-hydroxydocosa-4,8,12-trienyl] 2-(trimethylazaniumyl)ethyl phosphate
[(4E,8E,12E)-3-hydroxy-2-(pentanoylamino)nonadeca-4,8,12-trienyl] 2-(trimethylazaniumyl)ethyl phosphate
[(4E,8E,12E)-2-(hexanoylamino)-3-hydroxyoctadeca-4,8,12-trienyl] 2-(trimethylazaniumyl)ethyl phosphate
[(4E,8E,12E)-2-(heptanoylamino)-3-hydroxyheptadeca-4,8,12-trienyl] 2-(trimethylazaniumyl)ethyl phosphate
[(4E,8E,12E)-3-hydroxy-2-(propanoylamino)henicosa-4,8,12-trienyl] 2-(trimethylazaniumyl)ethyl phosphate
[(4E,8E,12E)-2-(butanoylamino)-3-hydroxyicosa-4,8,12-trienyl] 2-(trimethylazaniumyl)ethyl phosphate
[(E)-2-[[(9Z,12Z)-hexadeca-9,12-dienoyl]amino]-3-hydroxyoct-4-enyl] 2-(trimethylazaniumyl)ethyl phosphate
[(4E,8E,12E)-2-(decanoylamino)-3-hydroxytetradeca-4,8,12-trienyl] 2-(trimethylazaniumyl)ethyl phosphate
[1-acetyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] (9Z,12Z)-octadeca-9,12-dienoate
[1-butanoyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] (9Z,12Z)-hexadeca-9,12-dienoate
[1-propanoyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] (9Z,12Z)-heptadeca-9,12-dienoate
[2-[[(7Z,10Z,13Z)-hexadeca-7,10,13-trienoyl]amino]-3-hydroxyoctyl] 2-(trimethylazaniumyl)ethyl phosphate
(1-butanoyloxy-3-phosphonooxypropan-2-yl) (10Z,13Z,16Z)-docosa-10,13,16-trienoate
(1-octanoyloxy-3-phosphonooxypropan-2-yl) (9Z,12Z,15Z)-octadeca-9,12,15-trienoate
(1-hexanoyloxy-3-phosphonooxypropan-2-yl) (11Z,14Z,17Z)-icosa-11,14,17-trienoate
(1-decanoyloxy-3-phosphonooxypropan-2-yl) (7Z,10Z,13Z)-hexadeca-7,10,13-trienoate
[1-[(E)-dec-4-enoyl]oxy-3-phosphonooxypropan-2-yl] (4E,7E)-hexadeca-4,7-dienoate
(1-decanoyloxy-3-phosphonooxypropan-2-yl) (9E,11E,13E)-hexadeca-9,11,13-trienoate
2-[hydroxy-[3-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoxy]-2-propanoyloxypropoxy]phosphoryl]oxyethyl-trimethylazanium
2-[[3-butanoyloxy-2-[(4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoyl]oxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium
2-[[3-acetyloxy-2-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyl]oxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium
2-[[3-[(4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoxy]-2-pentanoyloxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium
Cuc B
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].
(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,3r,4s,5s,6r,11s)-8-[(2r)-butan-2-yl]-2-[(1r)-1-(6-ethyl-3,5-dimethyl-4-oxopyran-2-yl)ethyl]-3,5,9,11-tetramethyl-10-oxo-1,7-dioxaspiro[5.5]undec-8-en-4-yl 3-methylbutanoate
(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
(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
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
6,10,15,15-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-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
(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
(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
3-{4-hydroxy-9a,11a-dimethyl-7-oxo-1h,2h,3h,3ah,3bh,4h,5h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl}-1-(2,3,3-trimethyloxiran-2-yl)butan-2-yl 3-(methylsulfanyl)-3-oxopropanoate
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,3as,3bs,4r,9ar,9bs,11ar)-4-hydroxy-9a,11a-dimethyl-1-[(1s)-1-[(1s,3r,5r)-5,6,6-trimethyl-1-[2-(methylsulfanyl)-2-oxoethyl]-2,7,8-trioxabicyclo[3.2.1]octan-3-yl]ethyl]-1h,2h,3h,3ah,3bh,4h,5h,9bh,10h,11h-cyclopenta[a]phenanthren-7-one
2,3-dihydroxy-12-oleanene-28,30-dioic acid; (2β,3β)-form,2-ac,28-me ester
{"Ingredient_id": "HBIN004036","Ingredient_name": "2,3-dihydroxy-12-oleanene-28,30-dioic acid; (2\u03b2,3\u03b2)-form,2-ac,28-me ester","Alias": "NA","Ingredient_formula": "C33H50O7","Ingredient_Smile": "NA","Ingredient_weight": "558.75","OB_score": "NA","CAS_id": "95260-98-3","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8942","PubChem_id": "NA","DrugBank_id": "NA"}
2,3-dihydroxy-12-oleanene-28,30-dioic acid; (2β,3β)-form,3-ac,28-me ester
{"Ingredient_id": "HBIN004037","Ingredient_name": "2,3-dihydroxy-12-oleanene-28,30-dioic acid; (2\u03b2,3\u03b2)-form,3-ac,28-me ester","Alias": "NA","Ingredient_formula": "C33H50O7","Ingredient_Smile": "NA","Ingredient_weight": "558.75","OB_score": "NA","CAS_id": "95260-97-2","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8941","PubChem_id": "NA","DrugBank_id": "NA"}
3-epi-isocucurbitacin b
{"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"}