Exact Mass: 450.2829
Exact Mass Matches: 450.2829
Found 500 metabolites which its exact mass value is equals to given mass value 450.2829
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Usambarine
Celastrol
Celastrol, a plant-derived triterpene, has antioxidant and anti-inflammatory activity that may prevent neuronal degeneration in Alzheimers disease (AD). In the brains of patients with AD signs of neuronal degeneration are accompanied by markers of microglial activation, inflammation, and oxidant damage. The presence of nitrotyrosine in the cell bodies of neurons in AD suggests that peroxynitrite contributes to the pathogenesis of the disease. In low nanomolar concentrations celastrol was found to suppress the production by human monocytes and macrophages of the pro-inflammatory cytokines TNF-alpha and IL-1beta. Celastrol also decreased the induced expression of class II MHC molecules by microglia. In macrophage lineage cells and endothelial cells celastrol decreased induced but not constitutive NO production. Celastrol suppresses adjuvant arthritis in the rat, demonstrating in vivo anti-inflammatory activity. Low doses of celastrol administered to rats significantly improved their performance in memory, learning and psychomotor activity tests. The potent antioxidant and anti-inflammatory activities of celastrol, and its effects on cognitive functions, suggest that the drug may be useful to treat neurodegenerative diseases accompanied by inflammation, such as AD. (PMID: 11513350) [HMDB] Celastrol, a plant-derived triterpene, has antioxidant and anti-inflammatory activity that may prevent neuronal degeneration in Alzheimers disease (AD). In the brains of patients with AD signs of neuronal degeneration are accompanied by markers of microglial activation, inflammation, and oxidant damage. The presence of nitrotyrosine in the cell bodies of neurons in AD suggests that peroxynitrite contributes to the pathogenesis of the disease. In low nanomolar concentrations celastrol was found to suppress the production by human monocytes and macrophages of the pro-inflammatory cytokines TNF-alpha and IL-1beta. Celastrol also decreased the induced expression of class II MHC molecules by microglia. In macrophage lineage cells and endothelial cells celastrol decreased induced but not constitutive NO production. Celastrol suppresses adjuvant arthritis in the rat, demonstrating in vivo anti-inflammatory activity. Low doses of celastrol administered to rats significantly improved their performance in memory, learning and psychomotor activity tests. The potent antioxidant and anti-inflammatory activities of celastrol, and its effects on cognitive functions, suggest that the drug may be useful to treat neurodegenerative diseases accompanied by inflammation, such as AD. (PMID: 11513350). Celastrol is a pentacyclic triterpenoid that is 24,25,26-trinoroleana-1(10),3,5,7-tetraen-29-oic acid bearing an oxo substituent at position 2, a hydroxy substituent at position 3 and two methyl groups at positions 9 and 13. An antioxidant and anti-inflammatory agent. Potently inhibits lipid peroxidation in mitochondria and inhibits TNF-alpha-induced NFkappaB activation. Also shown to inhibit topoisomerase II activity in vitro (IC50 = 7.41 muM). It has a role as an antioxidant, an anti-inflammatory drug, an EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor, an antineoplastic agent, a Hsp90 inhibitor and a metabolite. It is a pentacyclic triterpenoid and a monocarboxylic acid. Celastrol is a natural product found in Reissantia buchananii, Crossopetalum gaumeri, and other organisms with data available. A pentacyclic triterpenoid that is 24,25,26-trinoroleana-1(10),3,5,7-tetraen-29-oic acid bearing an oxo substituent at position 2, a hydroxy substituent at position 3 and two methyl groups at positions 9 and 13. An antioxidant and anti-inflammatory agent. Potently inhibits lipid peroxidation in mitochondria and inhibits TNF-alpha-induced NFkappaB activation. Also shown to inhibit topoisomerase II activity in vitro (IC50 = 7.41 muM).
Vanoxerine
D018377 - Neurotransmitter Agents > D014179 - Neurotransmitter Uptake Inhibitors > D018765 - Dopamine Uptake Inhibitors C78272 - Agent Affecting Nervous System > C66884 - Dopamine Agonist D018377 - Neurotransmitter Agents > D015259 - Dopamine Agents D049990 - Membrane Transport Modulators
DG(2:0/PGJ2/0:0)
DG(2:0/PGJ2/0:0) belongs to the family of Diacylglycerols. These are glycerolipids lipids containing a common glycerol backbone to which at least one fatty acyl group is esterified. DG(2:0/PGJ2/0:0) is also a substrate of diacylglycerol kinase. It is involved in the phospholipid metabolic pathway.
DG(PGJ2/2:0/0:0)
DG(PGJ2/2:0/0:0) belongs to the family of Diacylglycerols. These are glycerolipids lipids containing a common glycerol backbone to which at least one fatty acyl group is esterified. DG(PGJ2/2:0/0:0) is also a substrate of diacylglycerol kinase. It is involved in the phospholipid metabolic pathway.
DG(2:0/0:0/PGJ2)
DG(2:0/0:0/PGJ2) belongs to the family of Diacylglycerols. These are glycerolipids lipids containing a common glycerol backbone to which at least one fatty acyl group is esterified. It is involved in the phospholipid metabolic pathway.
DG(PGJ2/0:0/2:0)
DG(PGJ2/0:0/2:0) belongs to the family of Diacylglycerols. These are glycerolipids lipids containing a common glycerol backbone to which at least one fatty acyl group is esterified. It is involved in the phospholipid metabolic pathway.
Sodium stearoyl 2-lactylate
It is used in foods as a dough strengthener, emulsifier, stabiliser, surface active agent, formulation aid, processing aid and texturiser.
[1R-[1R*,4R*,6S*(Z),9R*,10R*(Z),11R*]]-[9-(1-Hydroxy-1-methylethyl)-1-methyl-10-[(2-methyl-1-oxo-2-butenyl)oxy]-5,12-dioxatricyclo[9.1.0.04,6]dodec-6-yl]methyl ester 2-methyl-2-butenoic acid
3-Me ether-2,3-Dihydroxy-24,29-dinor-1,3,5(10),7-friedelatetraene-6,21-dione|3-methyl-6-oxo-tingenol|3-O-methyl-6-oxotingenol
16-(2-methyl-2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-17-nor-coryn-19-ene|Usambarin
drebyssogenin J|Drebyssogenin J; 11,12-Di-O-acetyl-drevogenin D|Drebyssogenin J; 11,12-Di-O-aetyldrevogenin D
12beta,16beta 22-trihydroxy-24-methyl-24-oxoscalaran-25-oic acid
18-O-(Z)-p-coumaroylbeyer-15-ene-11beta,18-diol|obtsurin D
8-angeloyloxy-3beta,4beta,10,11-bisepoxy-1beta-(2-methylbutyryloxy)bisabol-7(14)-en-2beta-ol
(12R) 18-nor-12,15,16-triacetoxy-neo-cleroda-4(18),13E-dien|Tri-Ac-12,15,16-Trihydroxy-18-nor-13-cleroden-4-one
(Z)-Cinnamoyl-(ent-13E)-15-Hydroxy-1(10),13-halimadien-18-oic acid
5-<4alpha-ethenyl-4beta-methyl-3beta-(1-methylethenyl)cyclohex-1beta-yl>-3aalpha,3,4,5,6,7,8,8a,9,9aalpha-decahydro-5beta,8abeta-dimethylspirofuran-3,2-2H-pyran>-2(3H)-on|5-[4alpha-ethenyl-4beta-methyl-3beta-(1-methylethenyl)cyclohex-1beta-yl]-3aalpha,3,4,5,6,7,8,8a,9,9aalpha-decahydro-5beta,8abeta-dimethylspiro(naphtho[2,3-b]furan-3,2-2H-pyran)-2(3H)-on
[1R-[1R*,4R*,6S*(Z),9R*,10R*(Z),11R*]]-[9-(1-Hydroxy-1-methylethyl)-1-methyl-10-[(2-methyl-1-oxo-2-butenyl)oxy]-5,12-dioxatricyclo[9.1.0.04,6]dodec-6-yl]methyl ester 2-methyl-2-butenoic acid
1alpha,6beta,7beta,14beta-tetrahydroxy-20-isoamoxy-7alpha,20-epoxy-ent-kaur-16-en-15-one|hebeirubescensin B
1alpha,6beta,7beta,11beta-tetrahydroxy-20-isoamoxy-7alpha,20-epoxy-ent-kaur-16-en-15-one|hebeirubescensin E
10,11-dimethoxy-emet-1-ene-6,7-diol|Desmethylpsychotrin
5-<4alpha-ethenyl-4beta-methyl-3beta-(1-methylethenyl)cyclohex-1beta-yl>-3aalpha,3,4,4,4a,5,6,7,8,8a,9,9aalpha-dodecahydro-8abeta-methyl-15-methylidenspirofuran-3,2-2H-pyran>-2(3H)-on|5-[4alpha-ethenyl-4beta-methyl-3beta-(1-methylethenyl)cyclohex-1beta-yl]-3aalpha,3,4,4,4a,5,6,7,8,8a,9,9aalpha-dodecahydro-8abeta-methyl-15-methylidenspiro(naphtho[2,3-b]furan-3,2-2H-pyran)-2(3H)-on
3alpha-hydroxylanosta-7,9(11),22E,24-tetraen-26,23-olide
6alpha,8alpha,15(S)-trihydroxy-23-carboxy-labd-13(14),17-dien-16(S),19-olide
bis<5Z-7-oxo-caryophyllene>-14-O-ether|bis[5Z-7-oxo-caryophyllene]-14-O-ether
ent-(16S)-1alpha,14alpha-diacetoxy-7beta-hydroxy-17-methoxykauran-15-one|ent-(16S)-1??,14??-Diacetoxy-7??-hydroxy-17-methoxykauran-15-one
4alpha,6alpha,19-trihydroxy-18-tigloyloxy-neo-clerod-13-en-15,16-olide|ajugaciliatin J
wilforol B
A pentacyclic triterpenoid with formula C29H38O4, originally isolated from the root bark of Tripterygium wilfordii.
25(9>8),26(13->14)abeo-24-nor-8,14-seco-friedelan-2,3-dihydroxy-1,3,5(10),6,8-pentaen-29(13)-olide
25(9->8)abeo-24-nor-8,14-seco-friedelan-2,3-dihydroxy-1,3,5(10),6,8,14(27)-hexaen-29-oic acid
4-guaiene-11-O-beta-D-(3-angeloxy-6-deoxy)glucopyranoside|undulatumoside A
1(5)-guaiene-11-O-beta-D-(3-angeloxy-6-deoxy)glucopyranoside|undulatumoside B
O-3-senecioyl alpha-bisabolol beta-D-fucopyranoside
2beta,10-diangeloyloxy-3beta,4beta-epoxy-8,11-dihydroxybisabol-7(14)-ene
methyl 6alpha-hydroxy-7alpha-butyryloxy-8beta,14beta-diformylpodocarpane-13beta-carboxylate
(2,3-dihydro-3-methylenebenzo[b]oxepin-7-yl)methyl linoleate
(22Z)-3alpha-hydroxy-17,14-fridolanosta-7,14,22,24-tetraen-26,23-olide|7,14,22Z,24-mariesatetraen-26,23-olide-3alpha-ol|pindrolactone
2-O-angeloyl-alpha-bisabolol-beta-D-fucopyranoside
3aalpha,3,4,5,6,7,8,8a,9,9aalpha-decahydro-5beta,8abeta-dimethyl-5-(4abeta-methyl-8-methyliden-2beta-naphthyl)spiro-furan-3,2-2H-pyran>-2(3H)-on|3aalpha,3,4,5,6,7,8,8a,9,9aalpha-decahydro-5beta,8abeta-dimethyl-5-(4abeta-methyl-8-methyliden-2beta-naphthyl)spiro[naphtho[2,3-b]-furan-3,2-2H-pyran]-2(3H)-on
(5S,6R,8R,9R,10S,13S,16R)-6-acetoxy-9,13-epoxy-16-butoxy-labdan-15,16-olide|viteagnusin E
(2R)-1-acetoxy-6-(2-acetoxypentadecyl)-2-methoxy-4-hydroxybenzene
(20R)-O-(3)-alpha-L-arabinopyranosyl-pregn-5-en-3beta,20-diol
8alpha,13,14-erythro-trihydroxy-labda-15,17-dien-16,19-olid-23-oic acid|8alpha,13,14-threo-trihydroxy-labda-15,17-dien-16,19-olid-23-oic acid
methyl 15,16-dideoxy-15alpha,17beta-dihydroxy-15,17-oxidospongian-16-carboxylate 15,17-diacetate
cubebol-(beta-6-desoxyglucopyranoside-4-O-angelate)
2-hydroxy-3-methyl-21-oxo-12,24-dinor-D:B-friedoleane-1,3,5(10),7-tetraen-29-oic acid|rel-(2R,4aR,6aR,12bR,13aR,13bS)-2,3,4,4a,5,6,6a,8,12b,13,13a,13b-dodecahydro-11-hydroxy-2,4a,6a,9,10,12b,13a-heptamethyl-3-oxo-1H-dibenzo[a,i]fluorene-2-carboxylic acid
C26H42O6_2-(4a-Methyl-8-methylenedecahydro-2-naphthalenyl)-2-propanyl 6-deoxy-2-O-[(2E)-2-methyl-2-butenoyl]hexopyranoside
Ala Phe Ile Thr
Ala Phe Leu Thr
Ala Phe Thr Ile
Ala Phe Thr Leu
Ala Ile Phe Thr
Ala Ile Thr Phe
Ala Leu Phe Thr
Ala Leu Thr Phe
Ala Thr Phe Ile
Ala Thr Phe Leu
Ala Thr Ile Phe
Ala Thr Leu Phe
Ala Val Val Tyr
Ala Val Tyr Val
Ala Tyr Val Val
Phe Ala Ile Thr
Phe Ala Leu Thr
Phe Ala Thr Ile
Phe Ala Thr Leu
Phe Ile Ala Thr
Phe Ile Thr Ala
His Pro Val Val
His Val Pro Val
His Val Val Pro
Pro His Val Val
Pro Val His Val
Pro Val Val His
Val His Pro Val
Val His Val Pro
Val Pro His Val
Val Pro Val His
Val Val His Pro
Val Val Pro His
(5Z,7E)-(3S)-24-(dimethoxyphosphoryl)-9,10-seco-5,7,10(19)-cholatrien-3-ol
2α-chloro-1β,25-dihydroxyvitamin D3 / 2α-chloro-1β,25-dihydroxycholecalciferol
2β-chloro-1α,25-dihydroxyvitamin D3
24-(dimethoxyphosphoryl)-25,26,27-trinorvitamin D3
2alpha-chloro-1beta,25-dihydroxyvitamin D3
2beta-chloro-1alpha,25-dihydroxyvitamin D3
2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl prop-2-enoate
Naluzotan
D018377 - Neurotransmitter Agents > D018490 - Serotonin Agents > D017366 - Serotonin Receptor Agonists C78272 - Agent Affecting Nervous System > C66885 - Serotonin Antagonist
4-Heptyloxyphenyl 4-trans-(4-butylcyclohexyl)benzoate
24-(dimethoxyphosphoryl)-25,26,27-trinorvitamin D3/24-(dimethoxyphosphoryl)-25,26,27-trinorcholecalciferol
2alpha-chloro-1beta,25-dihydroxyvitamin D3/2alpha-chloro-1beta,25-dihydroxycholecalciferol
[3,9-Dicarboxy-2,6,10-trihydroxy-6-methyl-4,8-dioxo-11-(trimethylazaniumyl)undecyl]-trimethylazanium
N-[3-[4-(2,5-dimethylphenyl)-1-piperazinyl]propyl]-2-(6-methyl-3-oxo-4H-1,4-benzoxazin-2-yl)acetamide
Seldomycin 5
An aminoglycoside antibiotic that is part of an antimicrobial complex consisting of factors 1,2,3,5 from a soil isolate named Streptomyces hofunensis.
Glucosyltestosterone
A steroid saponin that is the alpha-D-glucopyranosyl derivative of testosterone. It has been found in Daphnia magna.
N-[[(10S,11S)-13-[(2R)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-N-methylcyclopropanecarboxamide
3-cyclopentyl-1-[[(8S,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methylurea
3-cyclopentyl-1-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methylurea
3-cyclopentyl-1-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methylurea
N-[[(10R,11R)-13-[(2R)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-N-methylcyclopropanecarboxamide
N-[[(10R,11S)-13-[(2S)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-N-methylcyclopropanecarboxamide
3-cyclopentyl-1-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methylurea
3-cyclopentyl-1-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methylurea
N-[[(10S,11S)-13-[(2S)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-N-methylcyclopropanecarboxamide
(2R)-2-[(4S,5R)-8-(1-cyclohexenyl)-4-methyl-5-[[methyl(propyl)amino]methyl]-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol
N-[[(10R,11S)-13-[(2R)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-N-methylcyclopropanecarboxamide
3-cyclopentyl-1-[[(8S,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methylurea
(2S)-2-[(4S,5R)-8-(1-cyclohexenyl)-4-methyl-5-[[methyl(propyl)amino]methyl]-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol
(2R)-2-[(4S,5S)-8-(1-cyclohexenyl)-4-methyl-5-[[methyl(propyl)amino]methyl]-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol
(2S)-2-[(4R,5S)-8-(1-cyclohexenyl)-4-methyl-5-[[methyl(propyl)amino]methyl]-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol
(2S)-2-[(4R,5R)-8-(1-cyclohexenyl)-4-methyl-5-[[methyl(propyl)amino]methyl]-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol
(2R)-2-[(4R,5S)-8-(1-cyclohexenyl)-4-methyl-5-[[methyl(propyl)amino]methyl]-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol
N-[[(10S,11R)-13-[(2S)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-N-methylcyclopropanecarboxamide
N-[[(10R,11R)-13-[(2S)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-N-methylcyclopropanecarboxamide
(6R,7R,8R)-7-[4-(2-cyclohexylethynyl)phenyl]-8-(hydroxymethyl)-4-[4-oxanyl(oxo)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
2-[[(2R)-2-amino-3-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]sulfanylpropanoyl]amino]acetic acid
(2-hydroxy-3-phosphonooxypropyl) (Z)-nonadec-9-enoate
[(E)-2-(heptanoylamino)-3-hydroxynon-4-enyl] 2-(trimethylazaniumyl)ethyl phosphate
[(E)-3-hydroxy-2-(propanoylamino)tridec-4-enyl] 2-(trimethylazaniumyl)ethyl phosphate
[(E)-2-(butanoylamino)-3-hydroxydodec-4-enyl] 2-(trimethylazaniumyl)ethyl phosphate
[(E)-2-acetamido-3-hydroxytetradec-4-enyl] 2-(trimethylazaniumyl)ethyl phosphate
[(E)-3-hydroxy-2-(pentanoylamino)undec-4-enyl] 2-(trimethylazaniumyl)ethyl phosphate
[(E)-2-(hexanoylamino)-3-hydroxydec-4-enyl] 2-(trimethylazaniumyl)ethyl phosphate
[(E)-3-hydroxy-2-(octanoylamino)oct-4-enyl] 2-(trimethylazaniumyl)ethyl phosphate
3,4-Dimethyl-6-(2,5-dimethylphenyl)-6-phenyl-1,1-bis(trimethylsilyl)-1-sila-3-cyclohexene
Vanoxerine
D018377 - Neurotransmitter Agents > D014179 - Neurotransmitter Uptake Inhibitors > D018765 - Dopamine Uptake Inhibitors C78272 - Agent Affecting Nervous System > C66884 - Dopamine Agonist D018377 - Neurotransmitter Agents > D015259 - Dopamine Agents D049990 - Membrane Transport Modulators
LPMe(18:1)
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(2r,3r)-2-[(2s,4r)-7-hydroxy-4-methyl-6-methylideneoctan-2-yl]-6-oxo-2,3-dihydropyran-3-yl (2e,4e,6s)-8-hydroxy-6-(hydroxymethyl)-4-methylocta-2,4-dienoate
2-(6-hydroxy-4,6-dimethyloct-7-en-2-yl)-6-oxo-2,3-dihydropyran-3-yl 8-hydroxy-6-(hydroxymethyl)-4-methylocta-2,4-dienoate
[(1s,4r,5r,9s,10r,11s,13s)-11-hydroxy-5,9,13-trimethyltetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadec-14-en-5-yl]methyl (2e)-3-(4-hydroxyphenyl)prop-2-enoate
16-hydroxy-4,8,8,11,15-pentamethyl-3-oxatetracyclo[11.3.0.0²,⁴.0⁷,⁹]hexadec-10-en-13-yl 3-phenylprop-2-enoate
(1r,2s,3r,6r,7r,8r,9r,12s)-3-(acetyloxy)-12-hydroxy-6-isopropyl-3,9-dimethyl-13-methylidene-15-oxatricyclo[6.6.1.0²,⁷]pentadecan-9-yl butanoate
5-ethyl-6-[3,4,6-trihydroxy-10-(3-hydroxycyclohexyl)-3-(2-hydroxyethyl)deca-1,7,9-trien-1-yl]-5,6-dihydropyran-2-one
(2e)-n-[(3s,7s,10s)-3-[(2r)-butan-2-yl]-2,9-dihydroxy-7-methyl-5,6-dioxo-1,4,8-triazacyclotrideca-1,8-dien-10-yl]-6-methylhept-2-enimidic acid
3,9,10,15-tetrahydroxy-12,12-dimethyl-16-(3-methylbutoxy)-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-one
5,9-dimethyl-14-methylidene-15-[(3,4,5-trihydroxyoxan-2-yl)oxy]tetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane-5-carboxylic acid
(2e,6r)-6-[(1r,3ar,9ar,11ar)-3a,6,6,9a,11a-pentamethyl-7-oxo-1h,2h,3h,4h,10h,11h-cyclopenta[a]phenanthren-1-yl]-2-methylhept-2-enoic acid
(2e)-n-[2,9-dihydroxy-7-methyl-3-(2-methylpropyl)-5,6-dioxo-1,4,8-triazacyclotrideca-1,8-dien-10-yl]-6-methylhept-2-enimidic acid
2-[5-(2,3-dimethyloxiran-2-yl)-4-methylpentan-2-yl]-6-oxo-2,3-dihydropyran-3-yl 8-hydroxy-6-(hydroxymethyl)-4-methylocta-2,4-dienoate
3a,6,6,9a-tetramethyl-3-(6-methyl-7,10-dioxoundeca-3,5,8-trien-2-ylidene)-hexahydro-1h-cyclopenta[a]naphthalene-2,7-dione
(3-methylidene-2h-1-benzoxepin-7-yl)methyl octadeca-9,12-dienoate
1-({3-ethyl-9,10-dimethoxy-1h,2h,3h,4h,6h,7h,11bh-pyrido[2,1-a]isoquinolin-2-yl}methyl)-3,4-dihydroisoquinoline-6,7-diol
10-hydroxy-2,4a,6a,9,12b,14a-hexamethyl-11-oxo-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxylic acid
(2r,4as,6as,12br,14as,14br)-11-hydroxy-10-methoxy-2,4a,6a,9,12b,14a-hexamethyl-1,2,4,5,6,13,14,14b-octahydropicene-3,8-dione
(2s,3r,4s,5r,6r)-2-{[(1r,4ar,7r,8ar)-1,4a-dimethyl-7-(prop-1-en-2-yl)-octahydronaphthalen-1-yl]oxy}-3,5-dihydroxy-6-methyloxan-4-yl 3-methylbut-2-enoate
(1e)-2-[(1r,2r,7r)-2-[(3s)-3,4-dihydroxy-4-methylpentyl]-5-(hydroxymethyl)-2-methyl-6-oxo-7-(2-oxopropyl)cyclohept-4-en-1-yl]ethenyl 3-methylbut-2-enoate
methyl 2-(acetyloxy)-2-[5-(acetyloxy)-4-(1,4,4-trimethyl-8-methylidene-hexahydro-2h-azulen-1-yl)oxolan-3-yl]acetate
1-[2-(acetyloxy)-5-hydroxy-3-methoxyphenyl]pentadecan-2-yl acetate
3-(acetyloxy)-12-hydroxy-6-isopropyl-3,9-dimethyl-13-methylidene-15-oxatricyclo[6.6.1.0²,⁷]pentadecan-9-yl butanoate
(1s)-2-[(1r,4ar,5s,6r,8s,8ar)-8-hydroxy-8a-(hydroxymethyl)-5,6-dimethyl-hexahydro-2h-spiro[naphthalene-1,2'-oxiran]-5-yl]-1-(5-oxo-2h-furan-3-yl)ethyl (2s)-2-methylbutanoate
(4z,9s)-4-({[(4z,9s)-11,11-dimethyl-8-methylidene-3-oxobicyclo[7.2.0]undec-4-en-4-yl]methoxy}methyl)-11,11-dimethyl-8-methylidenebicyclo[7.2.0]undec-4-en-3-one
(2r,3r)-2-[(2s,4r,6s)-6-hydroxy-4,6-dimethyloct-7-en-2-yl]-6-oxo-2,3-dihydropyran-3-yl (2e,4e,6s)-8-hydroxy-6-(hydroxymethyl)-4-methylocta-2,4-dienoate
1-({3-ethyl-9-hydroxy-10-methoxy-1h,2h,3h,4h,6h,7h,11bh-pyrido[2,1-a]isoquinolin-2-yl}methyl)-7-methoxy-3,4-dihydroisoquinolin-6-ol
8,8,13,17-tetramethyl-16-[1-(6-oxo-2,3-dihydropyran-2-yl)ethyl]-7-oxatetracyclo[10.7.0.0³,⁹.0¹³,¹⁷]nonadeca-1(12),2,4-trien-6-one
1,6-dihydroxy-1-isopropyl-3a,6-dimethyl-8-[(2-methylbut-2-enoyl)oxy]-5-oxo-hexahydroazulen-4-yl 2-methylbut-2-enoate
(2r)-2-{2-[(1s,2r,4ar,8ar)-5-[(acetyloxy)methyl]-1,2,4a-trimethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]ethyl}-4-(acetyloxy)butyl acetate
[(1r,4ar,5s,6r,8s,8ar)-1,8-dihydroxy-8a-(hydroxymethyl)-5,6-dimethyl-5-[2-(5-oxo-2h-furan-3-yl)ethyl]-hexahydro-2h-naphthalen-1-yl]methyl 2-methylbut-2-enoate
(1r,3ar,5ar,9as,11ar)-3a,6,6,9a,11a-pentamethyl-1-[(2s)-1-(4-methylfuran-2-yl)-1-oxopropan-2-yl]-1h,2h,3h,4h,5h,5ah,8h,9h,10h,11h-cyclopenta[a]phenanthren-7-one
2-{[1,4a-dimethyl-7-(prop-1-en-2-yl)-octahydronaphthalen-1-yl]oxy}-3,5-dihydroxy-6-methyloxan-4-yl 2-methylbut-2-enoate
(1r,4z,9s)-4-({[(1r,4z,9s)-11,11-dimethyl-8-methylidene-3-oxobicyclo[7.2.0]undec-4-en-4-yl]methoxy}methyl)-11,11-dimethyl-8-methylidenebicyclo[7.2.0]undec-4-en-3-one
acetylcholic acid
{"Ingredient_id": "HBIN014466","Ingredient_name": "acetylcholic acid","Alias": "acetylcholicacid","Ingredient_formula": "C26H42O6","Ingredient_Smile": "CC(CCC(=O)O)C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)OC(=O)C)C)O)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "26109;350","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
argentatin f
{"Ingredient_id": "HBIN016714","Ingredient_name": "argentatin f","Alias": "NA","Ingredient_formula": "C30H42O3","Ingredient_Smile": "CC1C=CC(OC2C1C3(C=CC45CC46C=CC(=O)C(C6CCC5C3(C2)C)(C)C)C)C(C)(C)O","Ingredient_weight": "450.7 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1669","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101202039","DrugBank_id": "NA"}
5-{3,4-dihydroxy-3-methyl-5-[(2e)-3-methyl-5-oxofuran-2-ylidene]pentyl}-6-hydroxy-1,4a,6-trimethyl-hexahydro-2h-naphthalene-1-carboxylic acid
(1s,2s,8s,10r,14r,16s,21s,23r)-4-isopropyl-7,7,11,17,17-pentamethyl-6,22-dioxaheptacyclo[19.2.1.0¹,¹⁰.0²,¹⁴.0⁵,²³.0⁸,²³.0¹⁶,²¹]tetracosa-4,11-dien-3-one
(2r)-1-[2-(acetyloxy)-5-hydroxy-3-methoxyphenyl]pentadecan-2-yl acetate
2''-butoxy-2,5,5,8a-tetramethyl-5''-oxo-hexahydro-2h-dispiro[naphthalene-1,2':5',3''-bis(oxolane)]-4-yl acetate
(1r,4s,9s,11s,12r,16r,18s)-23-isopropyl-5,5,15,15,19-pentamethyl-14,24-dioxaheptacyclo[11.8.2.1⁹,¹².0¹,¹¹.0⁴,⁹.0¹¹,¹⁸.0¹²,¹⁶]tetracosa-13(23),19-dien-22-one
2-[2-(3,4-dihydroxy-4-methylpentyl)-5-(hydroxymethyl)-2-methyl-6-oxo-7-(2-oxopropyl)cyclohept-4-en-1-yl]ethenyl 3-methylbut-2-enoate
(6bs,8ar,9s,12ar,12bs,14ar)-3,9-dihydroxy-4,6b,8a,11,11,12b,14a-heptamethyl-8,9,12,12a,13,14-hexahydro-7h-picene-2,10-dione
(2r,3r)-2-[(2s,4r)-5-(2,3-dimethyloxiran-2-yl)-4-methylpentan-2-yl]-6-oxo-2,3-dihydropyran-3-yl (2e,4e,6s)-8-hydroxy-6-(hydroxymethyl)-4-methylocta-2,4-dienoate
2-{[1-(1-hydroxyethyl)-9a,11a-dimethyl-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-7-yl]oxy}oxane-3,4,5-triol
(2r,3r)-2-[(2s,4r)-5-[(2s,3s)-2,3-dimethyloxiran-2-yl]-4-methylpentan-2-yl]-6-oxo-2,3-dihydropyran-3-yl (2e,4e,6s)-8-hydroxy-6-(hydroxymethyl)-4-methylocta-2,4-dienoate
n-[2,9-dihydroxy-7-methyl-3-(2-methylpropyl)-5,6-dioxo-1,4,8-triazacyclotrideca-1,8-dien-10-yl]-6-methylhept-2-enimidic acid
16-hydroxy-2,5,8,11,13,17,18-heptamethyl-7-oxopentacyclo[11.8.0.0²,¹¹.0⁵,¹⁰.0¹⁴,¹⁹]henicosa-1(21),14,16,18-tetraene-8-carboxylic acid
5'-[4-ethenyl-4-methyl-3-(prop-1-en-2-yl)cyclohexyl]-5,8a-dimethyl-3',4',5,6,7,8,9,9a-octahydro-3ah-spiro[naphtho[2,3-b]furan-3,2'-pyran]-2-one
(9r,13r,16r,17r)-8,8,13,17-tetramethyl-16-[(1s)-1-[(2r)-6-oxo-2,3-dihydropyran-2-yl]ethyl]-7-oxatetracyclo[10.7.0.0³,⁹.0¹³,¹⁷]nonadeca-1(12),2,4-trien-6-one
(1e)-2-[(1s,2s,7s)-2-[(3r)-3,4-dihydroxy-4-methylpentyl]-5-(hydroxymethyl)-2-methyl-6-oxo-7-(2-oxopropyl)cyclohept-4-en-1-yl]ethenyl 3-methylbut-2-enoate
(2r,3r)-2-[(2s,4r,6r)-6-hydroxy-4,6-dimethyloct-7-en-2-yl]-6-oxo-2,3-dihydropyran-3-yl (2e,4e,6s)-8-hydroxy-6-(hydroxymethyl)-4-methylocta-2,4-dienoate
(3z,3as,5as,9ar,9bs)-3a,6,6,9a-tetramethyl-3-[(3e,5e,8e)-6-methyl-7,10-dioxoundeca-3,5,8-trien-2-ylidene]-hexahydro-1h-cyclopenta[a]naphthalene-2,7-dione
(2r,3r)-2-[(2s,4r)-6-hydroxy-4,6-dimethyloct-7-en-2-yl]-6-oxo-2,3-dihydropyran-3-yl (2e,4e,6s)-8-hydroxy-6-(hydroxymethyl)-4-methylocta-2,4-dienoate
4-[({11,11-dimethyl-8-methylidene-3-oxobicyclo[7.2.0]undec-4-en-4-yl}methoxy)methyl]-11,11-dimethyl-8-methylidenebicyclo[7.2.0]undec-4-en-3-one
(1s,2s,2''s,4s,4ar,5'r,8ar)-2''-butoxy-2,5,5,8a-tetramethyl-5''-oxo-hexahydro-2h-dispiro[naphthalene-1,2':5',3''-bis(oxolane)]-4-yl acetate
(3r,3as,5s,8ar,9ar)-5'-[(2s,4as,8as)-4a-methyl-8-methylidene-octahydronaphthalen-2-yl]-5,8a-dimethyl-3',4',5,6,7,8,9,9a-octahydro-3ah-spiro[naphtho[2,3-b]furan-3,2'-pyran]-2-one
(2r,4as,12br,14as,14br)-10-hydroxy-2,4a,6a,9,12b,14a-hexamethyl-11-oxo-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxylic acid
4-[4-(6,7-dihydroxy-2,5-dimethylnaphthalen-1-yl)-2-methylbutan-2-yl]-1,7-dimethyl-3-oxatricyclo[5.2.2.0⁴,⁸]undecan-2-one
5-{[1-hydroxy-5-(3-hydroxypropanoyl)-4,5-dimethyl-6-(sec-butyl)-2,3,4,4a,6,8a-hexahydro-1h-naphthalen-2-yl]oxy}-3-methyl-5-oxopent-3-enoic acid
4,5-dihydroxy-6-methyl-2-{[6-methyl-2-(4-methylcyclohex-3-en-1-yl)hept-5-en-2-yl]oxy}oxan-3-yl 2-methylbut-2-enoate
3,9-dihydroxy-4,6b,8a,11,11,12b,14a-heptamethyl-8,9,12,12a,13,14-hexahydro-7h-picene-2,10-dione
(2s)-6-methyl-2-[(1s,3r,8r,11s,12s,15r,16s)-7,7,12,16-tetramethyl-6-oxopentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadeca-4,17-dien-15-yl]hept-5-enoic acid
4-isopropyl-7,7,11,17,17-pentamethyl-6,22-dioxaheptacyclo[19.2.1.0¹,¹⁰.0²,¹⁴.0⁵,²³.0⁸,²³.0¹⁶,²¹]tetracosa-4,11-dien-3-one
3,5-dihydroxy-5-isopropyl-2a,7a-dimethyl-6-[(2-methylbut-2-enoyl)oxy]-hexahydro-1ah-azuleno[5,6-b]oxiren-2-yl 2-methylbut-2-enoate
(1s,3s,6r,7s,8s,9r)-3-[(2r,6r)-6-[(1s,4as,8ar)-4,7-dimethyl-1,2,4a,5,6,8a-hexahydronaphthalen-1-yl]heptan-2-yl]-2,4,10-trioxabicyclo[4.3.1]decane-7,8,9-triol
5-(2-{3a,6,6,9a,11a-pentamethyl-7-oxo-1h,2h,3h,5h,5ah,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl}propylidene)-3-methylfuran-2-one
3a,6,6,9a,11a-pentamethyl-1-[1-(4-methylfuran-2-yl)-1-oxopropan-2-yl]-1h,2h,3h,4h,5h,5ah,8h,9h,10h,11h-cyclopenta[a]phenanthren-7-one
(1s,3s,6r,7r,8s,9r)-3-[(2r,6r)-6-[(1s,4as,8ar)-4,7-dimethyl-1,2,4a,5,6,8a-hexahydronaphthalen-1-yl]heptan-2-yl]-2,4,10-trioxabicyclo[4.3.1]decane-7,8,9-triol
1-{[(2r,3r,11bs)-3-ethyl-10-hydroxy-9-methoxy-1h,2h,3h,4h,6h,7h,11bh-pyrido[2,1-a]isoquinolin-2-yl]methyl}-7-methoxy-3,4-dihydroisoquinolin-6-ol
(1r,4r,5r,6r,9r,11s,13s,14s,17r,22s)-9-(2-hydroxypropan-2-yl)-4,6,13,18,18-pentamethyl-10-oxahexacyclo[12.9.0.0¹,²².0⁴,¹³.0⁵,¹¹.0¹⁷,²²]tricosa-2,7,20-trien-19-one
(3-methylidene-2h-1-benzoxepin-7-yl)methyl (9z,12z)-octadeca-9,12-dienoate
(1s,2e,4r,6z,9e,11s)-4-[(3s)-3,4-dihydroxy-4-methylpentyl]-11-hydroxy-7-(hydroxymethyl)-4,11-dimethyl-8-oxocycloundeca-2,6,9-trien-1-yl 3-methylbut-2-enoate
(1s)-2-[(4ar,5s,6r,8s,8ar)-8-hydroxy-8a-(hydroxymethyl)-5,6-dimethyl-hexahydro-2h-spiro[naphthalene-1,2'-oxiran]-5-yl]-1-(5-oxo-2h-furan-3-yl)ethyl (2s)-2-methylbutanoate
methyl 5,12-dihydroxy-15-isopropyl-1,4,7,11-tetramethyl-17-oxo-6,18-dioxatricyclo[12.4.0.0⁵,⁹]octadeca-10,15-diene-8-carboxylate
6-(1-hydroxypropan-2-yl)-4,4a-dimethyl-7-oxo-1,2,3,4-tetrahydronaphthalen-1-yl 2-hydroxy-2-(hydroxymethyl)-4,6-dimethyloctanoate
5'-(4a-methyl-8-methylidene-octahydronaphthalen-2-yl)-5,8a-dimethyl-3',4',5,6,7,8,9,9a-octahydro-3ah-spiro[naphtho[2,3-b]furan-3,2'-pyran]-2-one
(5e)-5-[(2s)-2-[(1r,3ar,5ar,7r,9as,11ar)-7-hydroxy-3a,6,6,9a,11a-pentamethyl-1h,2h,3h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]propylidene]-3-methylfuran-2-one
10,11-dihydroxy-2,4,4a,6a,9,12b,14a-heptamethyl-1,2,4,5,6,13,14,14b-octahydropicene-3,8-dione
(1r,2s,3r,6r,7r,8r,9s,12s)-3-(acetyloxy)-12-hydroxy-6-isopropyl-3,9-dimethyl-13-methylidene-15-oxatricyclo[6.6.1.0²,⁷]pentadecan-9-yl butanoate
(5z)-5-[(2s)-2-[(1r,3ar,5as,9ar,9bs,11ar)-3a,6,6,9a,11a-pentamethyl-7-oxo-1h,2h,3h,5h,5ah,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]propylidene]-3-methylfuran-2-one
n-[2,9-dihydroxy-7-methyl-5,6-dioxo-3-(sec-butyl)-1,4,8-triazacyclotrideca-1,8-dien-10-yl]-6-methylhept-2-enimidic acid
(3z,5e,8s,9e,11z,14s,16r,17e,19r,20s,24s)-8,14,16,20-tetrahydroxy-19-methoxy-24-methyl-1-oxacyclotetracosa-3,5,9,11,17-pentaen-2-one
(2r)-6-methyl-2-[(1r,3s,8r,11s,12s,15r,16r)-7,7,12,16-tetramethyl-6-oxopentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadeca-4,17-dien-15-yl]hept-5-enoic acid
(2e)-n-(2,9-dihydroxy-3-isopropyl-7-methyl-5,6-dioxo-1,4,8-triazacyclotrideca-1,8-dien-10-yl)-6-methyloct-2-enimidic acid
(5z)-5-[(2r)-2-[(1s,5as,7r,9ar,9bs,11as)-7-hydroxy-1,6,6,9a,11a-pentamethyl-2h,5h,5ah,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]propylidene]-3-methylfuran-2-one
methyl 12-(butanoyloxy)-11-hydroxy-1,1,4a-trimethyl-8-oxo-dodecahydrophenanthro[1,10a-c]furan-7-carboxylate
(1r,2r,4s,7s,9r,10e,13s,15s,16s)-16-hydroxy-4,8,8,11,15-pentamethyl-3-oxatetracyclo[11.3.0.0²,⁴.0⁷,⁹]hexadec-10-en-13-yl (2e)-3-phenylprop-2-enoate
8,14,16,20-tetrahydroxy-19-methoxy-24-methyl-1-oxacyclotetracosa-3,5,9,11,17-pentaen-2-one
5-(2-{7-hydroxy-3a,6,6,9a,11a-pentamethyl-1h,2h,3h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl}propylidene)-3-methylfuran-2-one
(1r,3ar,5s,6r,8as)-6,8a-dihydroxy-1-isopropyl-3a,6-dimethyl-hexahydro-1h-azulen-5-yl 3,4,5-trimethoxybenzoate
(2r,4s,4ar,6as,12br,14as,14br)-10,11-dihydroxy-2,4,4a,6a,9,12b,14a-heptamethyl-1,2,4,5,6,13,14,14b-octahydropicene-3,8-dione
methyl (1r,4r,5s,7s,8r,9r,10e,12s,14s)-5,12-dihydroxy-15-isopropyl-1,4,7,11-tetramethyl-17-oxo-6,18-dioxatricyclo[12.4.0.0⁵,⁹]octadeca-10,15-diene-8-carboxylate
methyl (4ar,4br,7r,7ar,10ar,11s,12r,12as)-12-(butanoyloxy)-11-hydroxy-1,1,4a-trimethyl-8-oxo-dodecahydrophenanthro[1,10a-c]furan-7-carboxylate
9,10,15,18-tetrahydroxy-12,12-dimethyl-16-(3-methylbutoxy)-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-one
4-(acetyloxy)-2-(2-{5-[(acetyloxy)methyl]-1,2,4a-trimethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl}ethyl)butyl acetate
[(1s,4r,5r,9s,10r,11s,13s)-11-hydroxy-5,9,13-trimethyltetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadec-14-en-5-yl]methyl (2z)-3-(4-hydroxyphenyl)prop-2-enoate
(1r,2e,4s,6z,9z,11r)-4-[(3s)-3,4-dihydroxy-4-methylpentyl]-11-hydroxy-7-(hydroxymethyl)-4,11-dimethyl-8-oxocycloundeca-2,6,9-trien-1-yl 3-methylbut-2-enoate
(2s)-n-[(1s)-1-{[(9s,9ar)-2,4-diimino-hexahydro-1h-pyrido[1,2-a][1,3,5]triazin-9-yl]-c-hydroxycarbonimidoyl}-3-methylbutyl]-2-[(1-hydroxyethylidene)amino]-4-methylpentanimidic acid
(2e,6r)-n-[(3r,7s,10r)-2,9-dihydroxy-3-isopropyl-7-methyl-5,6-dioxo-1,4,8-triazacyclotrideca-1,8-dien-10-yl]-6-methyloct-2-enimidic acid
(1r,4r,5r,6r,9r,11s,13s,22s)-9-(2-hydroxypropan-2-yl)-4,6,13,18,18-pentamethyl-10-oxahexacyclo[12.9.0.0¹,²².0⁴,¹³.0⁵,¹¹.0¹⁷,²²]tricosa-2,7,20-trien-19-one
(3e,3as,5ar,9ar,9bs)-3a,6,6,9a-tetramethyl-3-[(3e,5e,8z)-6-methyl-7,10-dioxoundeca-3,5,8-trien-2-ylidene]-hexahydro-1h-cyclopenta[a]naphthalene-2,7-dione
(1s,2r,5r,8s,9r,10r,11s,15r,16s,18s)-9,10,15,18-tetrahydroxy-12,12-dimethyl-16-(3-methylbutoxy)-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-one
(1s,2r,3r,5r,8r,9r,10r,11s,15r,16r)-3,9,10,15-tetrahydroxy-12,12-dimethyl-16-(3-methylbutoxy)-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-one
(2r,3r)-2-[(2s,4r,7r)-7-hydroxy-4-methyl-6-methylideneoctan-2-yl]-6-oxo-2,3-dihydropyran-3-yl (2e,4e,6s)-8-hydroxy-6-(hydroxymethyl)-4-methylocta-2,4-dienoate
4-(3,4-dihydroxy-4-methylpentyl)-11-hydroxy-7-(hydroxymethyl)-4,11-dimethyl-8-oxocycloundeca-2,6,9-trien-1-yl 3-methylbut-2-enoate
2-[(4-amino-3-{[3-amino-6-(aminomethyl)oxan-2-yl]oxy}-2,6-dihydroxycyclohexyl)oxy]-5-methyl-4-(methylamino)oxane-3,5-diol
(3z,3as,5ar,9ar,9bs)-3a,6,6,9a-tetramethyl-3-[(3e,5e,8e)-6-methyl-7,10-dioxoundeca-3,5,8-trien-2-ylidene]-hexahydro-1h-cyclopenta[a]naphthalene-2,7-dione
(2e)-n-(2-aminoethyl)-3-{4-[(4e)-5-{4-[3-(furan-3-yl)propyl]furan-2-yl}-4-methylpent-4-en-1-yl]furan-2-yl}-2-methylprop-2-enimidic acid
3,11-bis(2-iminoimidazolidin-4-yl)-7,15-dimethyl-1,9-dioxacyclohexadecane-2,10-dione
(1r,4s,4as)-6-[(2s)-1-hydroxypropan-2-yl]-4,4a-dimethyl-7-oxo-1,2,3,4-tetrahydronaphthalen-1-yl 2-hydroxy-2-(hydroxymethyl)-4,6-dimethyloctanoate
{11-hydroxy-5,9,13-trimethyltetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadec-14-en-5-yl}methyl 3-(4-hydroxyphenyl)prop-2-enoate
(2e)-n-[(3s,7s,10s)-2,9-dihydroxy-7-methyl-3-(2-methylpropyl)-5,6-dioxo-1,4,8-triazacyclotrideca-1,8-dien-10-yl]-6-methylhept-2-enimidic acid
(1r,4z,9s)-4-({[(1s,5r,9r)-10,10-dimethyl-2,6-dimethylidene-7-oxobicyclo[7.2.0]undecan-5-yl]oxy}methyl)-11,11-dimethyl-8-methylidenebicyclo[7.2.0]undec-4-en-3-one
4,5-dihydroxy-6-({7-isopropyl-4,10-dimethyltricyclo[4.4.0.0¹,⁵]decan-4-yl}oxy)-2-methyloxan-3-yl 2-methylbut-2-enoate
(2s,3s,4r,5r)-2-{[(1r,3as,3bs,5ar,6s,7s,9ar,9bs,11ar)-1-ethenyl-7-hydroxy-9a,11a-dimethyl-tetradecahydro-1h-cyclopenta[a]phenanthren-6-yl]oxy}oxane-3,4,5-triol
(3r,3as,4ar,8ar,9ar)-5'-[(1s,3r,4r)-4-ethenyl-4-methyl-3-(prop-1-en-2-yl)cyclohexyl]-8a-methyl-5-methylidene-3',3a,4,4',4a,6,7,8,9,9a-decahydrospiro[naphtho[2,3-b]furan-3,2'-pyran]-2-one
(1s,4s,5r,6s,9r,11s,13s,14s,17r,22r)-9-(2-hydroxypropan-2-yl)-4,6,13,18,18-pentamethyl-10-oxahexacyclo[12.9.0.0¹,²².0⁴,¹³.0⁵,¹¹.0¹⁷,²²]tricosa-2,7,20-trien-19-one
10,11-dihydroxy-2,4a,6a,6b,9,14a-hexamethyl-3,4,5,6,14,14b-hexahydro-1h-picene-2-carboxylic acid
9-(2-hydroxypropan-2-yl)-4,6,13,18,18-pentamethyl-10-oxahexacyclo[12.9.0.0¹,²².0⁴,¹³.0⁵,¹¹.0¹⁷,²²]tricosa-2,7,20-trien-19-one
(1r,5r,7s)-7-[(1r,3as,3bs,9ar,9bs,11as)-1-hydroxy-9a,11a-dimethyl-9-oxo-2h,3h,3ah,3bh,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-4,4,5-trimethyl-2-oxabicyclo[3.2.1]octan-3-one
n-(2,9-dihydroxy-3-isopropyl-7-methyl-5,6-dioxo-1,4,8-triazacyclotrideca-1,8-dien-10-yl)-6-methyloct-2-enimidic acid
11-hydroxy-10-methoxy-2,4a,6a,9,12b,14a-hexamethyl-1,2,4,5,6,13,14,14b-octahydropicene-3,8-dione
(1s,2r,5r,8s,9r,10r,11s,15r,16r,18s)-9,10,15,18-tetrahydroxy-12,12-dimethyl-16-(3-methylbutoxy)-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-one
10-(acetyloxy)-3a,7-dihydroxy-1-(1-hydroxyethyl)-9a,11a-dimethyl-1h,2h,3h,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-11-yl acetate
[4,5-dihydroxy-5-(hydroxymethyl)-1,2-dimethyl-1-[2-(5-oxo-2h-furan-3-yl)ethyl]-hexahydro-2h-naphthalen-4a-yl]methyl 2-methylbut-2-enoate
(1r,4r,8s,9r)-4-[2-(6,7-dihydroxy-2,5-dimethylnaphthalen-1-yl)ethyl]-1,5,5,8-tetramethyl-3-oxatricyclo[6.2.2.0⁴,⁹]dodecan-2-one
2-({6,10-dimethyl-3-methylidene-2h,3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-2-yl}oxy)-6,10-dimethyl-3-methylidene-2h,3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan
(3r,3as,5s,8ar,9ar)-5'-[(1s,3r,4r)-4-ethenyl-4-methyl-3-(prop-1-en-2-yl)cyclohexyl]-5,8a-dimethyl-3',4',5,6,7,8,9,9a-octahydro-3ah-spiro[naphtho[2,3-b]furan-3,2'-pyran]-2-one
(1s,3as,3br,7s,9ar,9bs,10s,11s,11as)-10-(acetyloxy)-3a,7-dihydroxy-1-(1-hydroxyethyl)-9a,11a-dimethyl-1h,2h,3h,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-11-yl acetate
1-({3-ethyl-10-hydroxy-9-methoxy-1h,2h,3h,4h,6h,7h,11bh-pyrido[2,1-a]isoquinolin-2-yl}methyl)-7-methoxy-3,4-dihydroisoquinolin-6-ol
5'-[4-ethenyl-4-methyl-3-(prop-1-en-2-yl)cyclohexyl]-8a-methyl-5-methylidene-3',3a,4,4',4a,6,7,8,9,9a-decahydrospiro[naphtho[2,3-b]furan-3,2'-pyran]-2-one
(1s,3as,3br,7s,9ar,9bs,10s,11s,11as)-10-(acetyloxy)-3a,7-dihydroxy-1-[(1s)-1-hydroxyethyl]-9a,11a-dimethyl-1h,2h,3h,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-11-yl acetate
8-(acetyloxy)-2-hydroxy-14-(methoxymethyl)-5,5,9-trimethyl-15-oxotetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecan-16-yl acetate
(2e)-n-[(3s,7s,10r)-2,9-dihydroxy-7-methyl-3-(2-methylpropyl)-5,6-dioxo-1,4,8-triazacyclotrideca-1,8-dien-10-yl]-6-methylhept-2-enimidic acid
(1r,4as,5r,6r,8ar)-5-[(3s,4s)-3,4-dihydroxy-3-methyl-5-[(2e)-3-methyl-5-oxofuran-2-ylidene]pentyl]-6-hydroxy-1,4a,6-trimethyl-hexahydro-2h-naphthalene-1-carboxylic acid
2-[8-hydroxy-8a-(hydroxymethyl)-5,6-dimethyl-hexahydro-2h-spiro[naphthalene-1,2'-oxiran]-5-yl]-1-(5-oxo-2h-furan-3-yl)ethyl 2-methylbutanoate
(1r,9s,11s,12r,16r)-23-isopropyl-5,5,15,15,19-pentamethyl-14,24-dioxaheptacyclo[11.8.2.1⁹,¹².0¹,¹¹.0⁴,⁹.0¹¹,¹⁸.0¹²,¹⁶]tetracosa-13(23),19-dien-22-one
3-[6-(4,7-dimethyl-1,2,4a,5,6,8a-hexahydronaphthalen-1-yl)heptan-2-yl]-2,4,10-trioxabicyclo[4.3.1]decane-7,8,9-triol
(3z,3as,5ar,9ar,9bs)-3a,6,6,9a-tetramethyl-3-[(3e,5e,8z)-6-methyl-7,10-dioxoundeca-3,5,8-trien-2-ylidene]-hexahydro-1h-cyclopenta[a]naphthalene-2,7-dione
1-(3,3-dimethyloxiran-2-yl)-3-{5-hydroxy-6-methyl-4-[(2-methylbutanoyl)oxy]-7-oxabicyclo[4.1.0]heptan-3-yl}but-3-en-2-yl 2-methylbut-2-enoate
(2r,4as,6as,6bs,14as,14br)-10,11-dihydroxy-2,4a,6a,6b,9,14a-hexamethyl-3,4,5,6,14,14b-hexahydro-1h-picene-2-carboxylic acid
(1s,2s,6e,10e,13r,14s,15r,16r,19z)-16-isopropyl-7,11,19-trimethyl-24,26-dioxapentacyclo[13.7.2.1²,¹³.1³,¹³.0¹,¹⁴]hexacosa-3(25),6,10,19-tetraen-23-one
(2r,4ar,6ar,12bs,14ar,14bs)-10-hydroxy-2,4a,6a,9,12b,14a-hexamethyl-11-oxo-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxylic acid
(3ar,5ar,6s,9r,10ar)-9-hydroxy-1-isopropyl-3a,5a-dimethyl-6-{[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}-2h,3h,4h,5h,6h,9h,10h,10ah-cyclohepta[e]indene-8-carbaldehyde
(1r,4s,4as)-6-[(2r)-1-hydroxypropan-2-yl]-4,4a-dimethyl-7-oxo-1,2,3,4-tetrahydronaphthalen-1-yl 2-hydroxy-2-(hydroxymethyl)-4,6-dimethyloctanoate
(1r)-7-[(1s,9ar,11as)-1-hydroxy-9a,11a-dimethyl-9-oxo-2h,3h,3ah,3bh,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-4,4,5-trimethyl-2-oxabicyclo[3.2.1]octan-3-one
(2z,6r)-6-[(4ar,6br,9r,10as,11bs)-4,4,6b,11b-tetramethyl-10-methylidene-3-oxo-1h,2h,4ah,5h,7h,8h,9h,10ah-cyclohexa[a]fluoren-9-yl]-2-methylhept-2-enoic acid
6-{4,4,6b,11b-tetramethyl-10-methylidene-3-oxo-1h,2h,4ah,5h,7h,8h,9h,10ah-cyclohexa[a]fluoren-9-yl}-2-methylhept-2-enoic acid
1,5-dihydroxy-3,5'-diisopropyl-7,7,10a-trimethyl-5,6,6a,8,9,10-hexahydrospiro[acephenanthrylene-4,2'-bicyclo[3.1.0]hexan]-2-one
(1s,2s,3r,5s,8s,10s)-2,10-bis(acetyloxy)-14-hydroxy-8,12,15,15-tetramethyltricyclo[9.3.1.0³,⁸]pentadec-11-en-5-yl acetate
(5s,6s)-5-ethyl-6-[(1e,3r,4r,6r,7z,9z)-3,4,6-trihydroxy-10-[(1r,3s)-3-hydroxycyclohexyl]-3-(2-hydroxyethyl)deca-1,7,9-trien-1-yl]-5,6-dihydropyran-2-one
(2s,3r,4s,5r,6r)-4,5-dihydroxy-6-methyl-2-{[(2r)-6-methyl-2-[(1s)-4-methylcyclohex-3-en-1-yl]hept-5-en-2-yl]oxy}oxan-3-yl (2z)-2-methylbut-2-enoate
(1's,4s,5r,5'r,6as,10as)-1,5-dihydroxy-3,5'-diisopropyl-7,7,10a-trimethyl-5,6,6a,8,9,10-hexahydrospiro[acephenanthrylene-4,2'-bicyclo[3.1.0]hexan]-2-one
(2s,3r,4s,5r,6r)-2-{[(1ar,4r,4as,7r,7as,7bs)-1,1,4,7-tetramethyl-octahydro-1ah-cyclopropa[e]azulen-4-yl]oxy}-4,5-dihydroxy-6-methyloxan-3-yl (2e)-2-methylbut-2-enoate
(2r,3r)-2-[(2s,4r)-5-[(2r,3r)-2,3-dimethyloxiran-2-yl]-4-methylpentan-2-yl]-6-oxo-2,3-dihydropyran-3-yl (2e,4e,6s)-8-hydroxy-6-(hydroxymethyl)-4-methylocta-2,4-dienoate
(1r,2r,4r,8r,9r,10s,13s,14s,16r)-8-(acetyloxy)-2-hydroxy-14-(methoxymethyl)-5,5,9-trimethyl-15-oxotetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecan-16-yl acetate
2-(7-hydroxy-4-methyl-6-methylideneoctan-2-yl)-6-oxo-2,3-dihydropyran-3-yl 8-hydroxy-6-(hydroxymethyl)-4-methylocta-2,4-dienoate
9-hydroxy-1-isopropyl-3a,5a-dimethyl-6-[(3,4,5-trihydroxyoxan-2-yl)oxy]-2h,3h,4h,5h,6h,9h,10h,10ah-cyclohepta[e]indene-8-carbaldehyde
(1s,6r,7s,8s,9r)-3-[(2r,6r)-6-[(1s,4as,8ar)-4,7-dimethyl-1,2,4a,5,6,8a-hexahydronaphthalen-1-yl]heptan-2-yl]-2,4,10-trioxabicyclo[4.3.1]decane-7,8,9-triol
(2r,4as,8s,8ar)-8-[2-(6,7-dihydroxy-2,5-dimethylnaphthalen-1-yl)ethyl]-2,4a,8-trimethyl-7-methylidene-hexahydronaphthalene-2-carboxylic acid
(2r,3as,11ar)-2-{[(2r,3as,11ar)-6,10-dimethyl-3-methylidene-2h,3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-2-yl]oxy}-6,10-dimethyl-3-methylidene-2h,3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan
(1r,4s,5r,9s,10s,13r,15r)-5,9-dimethyl-14-methylidene-15-{[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}tetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane-5-carboxylic acid
(1ar,2r,2as,3s,5r,5as,6s,7as)-3,5-dihydroxy-5-isopropyl-2a,7a-dimethyl-6-{[(2z)-2-methylbut-2-enoyl]oxy}-hexahydro-1ah-azuleno[5,6-b]oxiren-2-yl (2z)-2-methylbut-2-enoate
(2s,3r,4s,5r,6r)-2-{[(1r,4ar,7r,8ar)-1,4a-dimethyl-7-(prop-1-en-2-yl)-octahydronaphthalen-1-yl]oxy}-3,5-dihydroxy-6-methyloxan-4-yl (2e)-2-methylbut-2-enoate
(5z)-5-[(2s)-2-[(1r,3ar,5as,9as,11ar)-3a,6,6,9a,11a-pentamethyl-7-oxo-1h,2h,3h,4h,5h,5ah,8h,9h,10h,11h-cyclopenta[a]phenanthren-1-yl]propylidene]-3-methylfuran-2-one
(3e,3as,9ar,9bs)-3a,6,6,9a-tetramethyl-3-[(3e,5e,8e)-6-methyl-7,10-dioxoundeca-3,5,8-trien-2-ylidene]-hexahydro-1h-cyclopenta[a]naphthalene-2,7-dione
2-{[1,4a-dimethyl-7-(prop-1-en-2-yl)-octahydronaphthalen-1-yl]oxy}-3,5-dihydroxy-6-methyloxan-4-yl 3-methylbut-2-enoate
1-{[(2r,3r,11bs)-3-ethyl-9,10-dimethoxy-1h,2h,3h,4h,6h,7h,11bh-pyrido[2,1-a]isoquinolin-2-yl]methyl}-3,4-dihydroisoquinoline-6,7-diol
(1's,4s,5s,5'r,6as,10as)-1,5-dihydroxy-3,5'-diisopropyl-7,7,10a-trimethyl-5,6,6a,8,9,10-hexahydrospiro[acephenanthrylene-4,2'-bicyclo[3.1.0]hexan]-2-one
(2r,3s,4r,5r,6s)-4,5-dihydroxy-6-{[(1r,4r,5r,6r,7s,10r)-7-isopropyl-4,10-dimethyltricyclo[4.4.0.0¹,⁵]decan-4-yl]oxy}-2-methyloxan-3-yl (2z)-2-methylbut-2-enoate
(2r,3r)-2-[(2s,4r,7s)-7-hydroxy-4-methyl-6-methylideneoctan-2-yl]-6-oxo-2,3-dihydropyran-3-yl (2e,4e,6s)-8-hydroxy-6-(hydroxymethyl)-4-methylocta-2,4-dienoate
3-ethenyl-2-({2-methyl-1h,3h,4h,9h-pyrido[3,4-b]indol-1-yl}methyl)-1h,2h,3h,4h,6h,7h,12h,12bh-indolo[2,3-a]quinolizine
5-(2-{3a,6,6,9a,11a-pentamethyl-7-oxo-1h,2h,3h,4h,5h,5ah,8h,9h,10h,11h-cyclopenta[a]phenanthren-1-yl}propylidene)-3-methylfuran-2-one
(2r,5r,8r,10s,11r,13r)-16-hydroxy-2,5,8,11,13,17,18-heptamethyl-7-oxopentacyclo[11.8.0.0²,¹¹.0⁵,¹⁰.0¹⁴,¹⁹]henicosa-1(21),14,16,18-tetraene-8-carboxylic acid
5-(2-{7-hydroxy-1,6,6,9a,11a-pentamethyl-2h,5h,5ah,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl}propylidene)-3-methylfuran-2-one
(2s)-1-[(2r)-3,3-dimethyloxiran-2-yl]-3-[(1s,3s,4r,5r,6r)-5-hydroxy-6-methyl-4-{[(2r)-2-methylbutanoyl]oxy}-7-oxabicyclo[4.1.0]heptan-3-yl]but-3-en-2-yl (2z)-2-methylbut-2-enoate
1-{[(2r,3r,11bs)-3-ethyl-9-hydroxy-10-methoxy-1h,2h,3h,4h,6h,7h,11bh-pyrido[2,1-a]isoquinolin-2-yl]methyl}-7-methoxy-3,4-dihydroisoquinolin-6-ol
(2s,3r,4s,5r)-2-{[(1r,3as,3bs,5ar,6s,7s,9ar,9bs,11ar)-1-ethenyl-7-hydroxy-9a,11a-dimethyl-tetradecahydro-1h-cyclopenta[a]phenanthren-6-yl]oxy}oxane-3,4,5-triol
(2s,3r,4s,5s)-2-{[(1s,3as,3bs,7s,9ar,9bs,11as)-1-[(1s)-1-hydroxyethyl]-9a,11a-dimethyl-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-7-yl]oxy}oxane-3,4,5-triol
(2s,3r,12bs)-3-ethenyl-2-{[(1s)-2-methyl-1h,3h,4h,9h-pyrido[3,4-b]indol-1-yl]methyl}-1h,2h,3h,4h,6h,7h,12h,12bh-indolo[2,3-a]quinolizine
N-{(2S)-1-[(4-ethylphenyl)amino]-1-oxopropan-2-yl}-1-(L-phenylalanyl)piperidine-4-carboxamide
TG(22:3CHO)
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MGMG(13:0)
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SM(d16:1)
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LPA(O-20:1)
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PEt(P-17:0)
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PA(O-9:0_10:1)
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TG(12:2_10:1CHO)
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TG(7:0_15:3CHO)
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TG(17:3_3:0_3:0)
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SM(t15:2)
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TG(15:3_8:0)
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PA(O-4:0_15:1)
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LPEt(17:1)
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PA(P-7:0_12:0)
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CerPE(d19:1)
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TG(16:3_2:0_5:0)
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TG(20:3_3:0)
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PEt(O-15:1_2:0)
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TG(15:3CHO_3:0_4:0)
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TG(16:3CHO_3:0_3:0)
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BisMeLPA(17:1)
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LPEt(O-18:1)
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TG(10:3CHO_6:0_6:0)
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TG(18:3_4:0CHO)
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TG(16:3_2:0_4:0CHO)
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PEt(P-10:0_7:0)
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TG(17:3_6:0)
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TG(13:2_10:1)
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PEt(P-11:0_6:0)
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LPMt(18:1)
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TG(4:0_19:3)
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TG(11:1CHO_11:2)
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PEt(O-13:1_4:0)
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PEt(O-17:1)
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TG(7:0_6:0_10:3)
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PEt(P-7:0_10:0)
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TG(6:0_6:0CHO_10:3)
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TG(7:0_5:0CHO_10:3)
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TG(10:2_6:0_6:1CHO)
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TG(6:0_6:1CHO_10:2)
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TG(5:0_6:0_11:3CHO)
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TG(9:1CHO_3:0_10:2)
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TG(8:0_4:0CHO_10:3)
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PEt(O-5:0_12:1)
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