Exact Mass: 512.325
Exact Mass Matches: 512.325
Found 500 metabolites which its exact mass value is equals to given mass value 512.325
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Acetoxolone
A - Alimentary tract and metabolism > A02 - Drugs for acid related disorders > A02B - Drugs for peptic ulcer and gastro-oesophageal reflux disease (gord) C78276 - Agent Affecting Digestive System or Metabolism > C29701 - Anti-ulcer Agent
3alpha-Acetoxy-11-keto-beta-boswellic acid
3alpha-Acetoxy-11-keto-beta-boswellic acid is found in herbs and spices. 3alpha-Acetoxy-11-keto-beta-boswellic acid is isolated from Boswellia serrata (Indian olibanum). Isolated from Boswellia serrata (Indian olibanum). 3alpha-Acetoxy-11-keto-beta-boswellic acid is found in herbs and spices. AKBA (Acetyl-11-keto-β-boswellic acid) is an active triterpenoid compound from the extract of Boswellia serrate and a novel Nrf2 activator. AKBA (Acetyl-11-keto-β-boswellic acid) is an active triterpenoid compound from the extract of Boswellia serrate and a novel Nrf2 activator. AKBA (Acetyl-11-keto-β-boswellic acid) is an active triterpenoid compound from the extract of Boswellia serrate and a novel Nrf2 activator.
Ganoderic acid Mf
Ganodermic acid TO is found in mushrooms. Ganodermic acid TO is a metabolite of Ganoderma lucidum (reishi). Metabolite of Ganoderma lucidum (reishi). Ganoderic acid Mf is found in mushrooms.
Glyuranolide
Glyuranolide is found in herbs and spices. Glyuranolide is a constituent of Glycyrrhiza uralensis (Chinese licorice). Constituent of Glycyrrhiza uralensis (Chinese licorice). Glyuranolide is found in herbs and spices.
Ganoderic acid S
Ganoderic acid S is found in mushrooms. Ganoderic acid S is a constituent of cultured mycelium of Ganoderma lucidum (reishi).
3beta-Acetoxy-12-oxo-28,13beta-oleananolide
3beta-Acetoxy-12-oxo-28,13beta-oleananolide is found in fruits. 3beta-Acetoxy-12-oxo-28,13beta-oleananolide is a constituent of Rhodomyrtus tomentosa (hill gooseberry) Constituent of Rhodomyrtus tomentosa (hill gooseberry). (3b,12a,13b)-3-Hydroxy-12-oxo-28,13-oleanolide 3-acetate is found in fruits.
Ganoderic acid X
Ganodermic acid TN is found in mushrooms. Ganodermic acid TN is a metabolite of Ganoderma lucidum (reishi).
11a,12a-Epoxy-3b-hydroxy-28,13-oleananolide 3-acetate
11a,12a-Epoxy-3b-hydroxy-28,13-oleananolide 3-acetate is found in fruits. 11a,12a-Epoxy-3b-hydroxy-28,13-oleananolide 3-acetate is a constituent of Rhodomyrtus tomentosa (hill gooseberry) Constituent of Rhodomyrtus tomentosa (hill gooseberry). 11a,12a-Epoxy-3b-hydroxy-28,13-oleananolide 3-acetate is found in fruits.
Carindone
Carindone is found in beverages. Carindone is a constituent of Carissa carandas (karanda). Constituent of Carissa carandas (karanda). Carindone is found in beverages and fruits.
1-Stearoylglycerophosphoglycerol
1-Stearoylglycerophosphoglycerol is a phosphatidylglycerol. It is a glycerophospholipid in which a phosphorylserine moiety occupies a glycerol substitution site. As is the case with diacylglycerols, phosphatidylserines can have many different combinations of fatty acids of varying lengths and saturation attached at the C-1 and C-2 positions. PG(18:0/0:0), in particular, consists of two octadecanoyl chains at positions C-1 and C-2. In E. coli glycerophospholipid metabolism, phosphatidylglycerol is formed from phosphatidic acid (1,2-diacyl-sn-glycerol 3-phosphate) by a sequence of enzymatic reactions that proceeds via two intermediates, cytidine diphosphate diacylglycerol (CDP-diacylglycerol) and phosphatidylglycerophosphate (PGP, a phosphorylated phosphatidylglycerol). Phosphatidylglycerols, along with CDP-diacylglycerol, also serve as precursor molecules for the synthesis of cardiolipin, a phospholipid found in membranes.
2-Stearoylglycerophosphoglycerol
2-Stearoylglycerophosphoglycerol is a phosphatidylglycerol. It is a glycerophospholipid in which a phosphorylserine moiety occupies a glycerol substitution site. As is the case with diacylglycerols, phosphatidylserines can have many different combinations of fatty acids of varying lengths and saturation attached at the C-1 and C-2 positions. PG(0:0/18:0), in particular, consists of two octadecanoyl chains at positions C-1 and C-2. In E. coli glycerophospholipid metabolism, phosphatidylglycerol is formed from phosphatidic acid (1,2-diacyl-sn-glycerol 3-phosphate) by a sequence of enzymatic reactions that proceeds via two intermediates, cytidine diphosphate diacylglycerol (CDP-diacylglycerol) and phosphatidylglycerophosphate (PGP, a phosphorylated phosphatidylglycerol). Phosphatidylglycerols, along with CDP-diacylglycerol, also serve as precursor molecules for the synthesis of cardiolipin, a phospholipid found in membranes.
3-Acetyl-11-keto-beta-boswellic acid
Pregnanetriol 3a-O-b-D-glucuronide
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
Acetoxolone
AcKBA
3-Acetyl-11-keto-beta-boswellic acid is a triterpenoid. 3-Acetyl-11-keto-beta-boswellic acid is a natural product found in Boswellia papyrifera, Boswellia sacra, and Boswellia serrata with data available. See also: Indian frankincense (part of). AKBA (Acetyl-11-keto-β-boswellic acid) is an active triterpenoid compound from the extract of Boswellia serrate and a novel Nrf2 activator. AKBA (Acetyl-11-keto-β-boswellic acid) is an active triterpenoid compound from the extract of Boswellia serrate and a novel Nrf2 activator. AKBA (Acetyl-11-keto-β-boswellic acid) is an active triterpenoid compound from the extract of Boswellia serrate and a novel Nrf2 activator.
Poricoic acid AM
Ganoderic Acid X
2-(3,7-dimethylocta-2,6-dienyl)-6-[7-(3,7-dimethylocta-2,6-dienyl)-5-hydroxybenzofuran-2-yl]-[1,4]benzoquinone|lettowifuraquinone
(2beta,3beta,5beta,22R)-2,3,5,14,20,22,25,26-octahydroxycholest-7-en-6-one|26-hydroxypolipodine B|26-hydroxypolypodin B|26-hydroxypolypodine B|5,20,26-trihydroxyecdysone
3-O-sulfothornasterol A tyrammonium salt|3-O-sulfothornasterol A tyramonium salt
(22E,24xi)-5alpha,6alpha-epoxy-24-methylcholesta-8,22-diene-3beta,7alpha-diol 3,7-diacetate|Melithasterol B Diacetate
3beta-(acetyloxy)-11alpha,12alpha-epoxy-13-hydroxyursan-28-oic acid gamma-lactone|3beta-acetoxy-11alpha,12alpha-epoxyurs-28,13-olide
(5E,9Z)-6-bromo-28-methyloctacosa-5,9-dienoic acid
(25R)-3??-Acetoxy-23-oxo-9,16-lanostandien-26-oic acid
(22E,24xi)-5alpha,6alpha-epoxy-24-methylcholesta-8(14),22-diene-3beta,7alpha-diol 3,7-diacetate
Di-Ac-(1beta,3beta)-Spirosta-5,25(27)-diene-1,3-diol
(23S,25R)-3alpha-acetoxy-17,23-epoxy-9,19-cyclo-9beta-lanostan-26,23-olide
28-acetyloxy-6alpha,7alpha:21beta,28-diepoxytaraxer-3alpha-ol
20(R),24(E)-6beta-Acetoxy-3-oxo-9beta-lanosta-7,24-dien-26-oic acid
1-O-(6,9,12,15-octadecatetraenoyl)-3-O-beta-D-galactopyranosyl glycerol
(+)-20-hydroxy-23-oxo-3,4-seco-lanosta-4(28),7(8),9(11),24(31)-tetraene-3,26-dicarboxylic acid|(+)-spongiporic acid B
21beta-acetoxy-22beta-hydroxy-3-oxours-12-en-28-al|cordianal A
(3beta,4beta,11alpha,12alpha,13beta)-11,12-epoxy-4,13-dihydroxy-3,23-(isopropylidenedioxy)-24,30-dinorolean-20(29)-en-28-oic acid 28,13-lactone
isopimaryl 3-methylenecarboxylate-4-hydroxy-4aalpha,7alpha,7aalpha-dihydronepetalactone
11-deoxyalisol C monoacetate|Ac-24,25-Epoxy-23-hydroxyprotost-13(17)-ene-3,16-dione
(6Z)-14-[3,5-dihydroxy-4-(3-hydroxy-3-methylbutyl)phenyl]-1-(3,5-dihydroxyphenyl)tetradec-6-en-1-one|(Z)-6,7-didehydroglaucone A|2-(3-hydroxyisopentyl)-5,5-[(6Z)-1-oxotetradec-6-en-1,14-diyl]bisresorcinol|6,7-cis-dehydroglaucone A
3beta-acetoxy-7beta,8beta-epoxy-5alpha-lanost-24-en-30,9alpha-olide
3beta-acetoxy-12beta-hydroxy-eupha-7,24-dien-21,16beta-olide
9-hydroxy-3,9-hemiacetal-8,8-dimethyl-3,5-di-(3-methyl-2-butenyl)-7-(3-al,3-methyl-2-butenyl)-1(2-methyl-butanoyl) bicyclo[3.3.1]nonane-2,4-dione|spiranthenone A
3beta-acetyloxy-1-oxo-olean-12-en-28-oic acid|Virgaticsaeureacetat
3alpha-acetoxy-19alpha-hydroxyursa-12,20(30)-dien-28-oic acid|baloic acid
3??-Hydroxy-16??-acetoxy-lanosta-7,9(11),24-trien-21-oic acid
(22S,24S)-16,24-anhydro-22,25-anhydro-2,16alpha,22,24,25-pentahydroxy-22-methoxy-3,11-dioxo-cucurbita-1,5-diene
(24Z)-3-Oxo-12??-acetoxylanosta-8,24-dien-26-oic acid
26,27-dinor-17-oxa-1,14,20(22)-trien-3,16-dioxo-7alpha-acetoxy-17beta-methoxy-4,4,8-trimethyl(5alpha,13alpha)-cholane|meliacinin
(3beta,4beta,11alpha,12alpha,13beta)-11,12-epoxy-3,13-dihydroxy-4,23-(isopropylidenedioxy)-24,30-dinorolean-20(29)-en-28-oic acid 28,13-lactone
3beta-acetoxy-13-hydroxy-23-oxo-oleanan-28-oic acid-lactone|3beta-Acetoxy-13-hydroxy-23-oxo-oleanan-28-saeure-lacton
5alpha,6alpha-epoxy-24-methylcholesta-8(14),24(28)-diene-3beta,7alpha-diol 3,7-diacetate
His Thr Lys Lys
3-O-Acetyl-16α-hydroxydehydrotrametenolic acid
3-O-Acetyl-16alpha-hydroxydehydrotrametenolic acid is a natural product found in Wolfiporia cocos with data available.
Dereplicator Identification - Monogalactosylmonoacylglycerol;_Hemolysi
His Lys Lys Thr
His Lys Thr Lys
Ile Lys Pro Arg
Ile Lys Arg Pro
Ile Pro Lys Arg
Ile Pro Gln Arg
Ile Pro Arg Lys
Ile Pro Arg Gln
Ile Gln Pro Arg
Ile Gln Arg Pro
Ile Arg Lys Pro
Ile Arg Pro Lys
Ile Arg Pro Gln
Ile Arg Gln Pro
Lys His Lys Thr
Lys His Thr Lys
Lys Ile Pro Arg
Lys Ile Arg Pro
Lys Lys His Thr
Lys Lys Thr His
Lys Leu Pro Arg
Lys Leu Arg Pro
Lys Pro Ile Arg
Lys Pro Leu Arg
Lys Pro Arg Ile
Lys Pro Arg Leu
Lys Arg Ile Pro
Lys Arg Leu Pro
Lys Arg Pro Ile
Lys Arg Pro Leu
Lys Thr His Lys
Lys Thr Lys His
Leu Lys Pro Arg
Leu Lys Arg Pro
Leu Pro Lys Arg
Leu Pro Gln Arg
Leu Pro Arg Lys
Leu Pro Arg Gln
Leu Gln Pro Arg
Leu Gln Arg Pro
Leu Arg Lys Pro
Leu Arg Pro Lys
Leu Arg Pro Gln
Leu Arg Gln Pro
Pro Ile Lys Arg
Pro Ile Gln Arg
Pro Ile Arg Lys
Pro Ile Arg Gln
Pro Lys Ile Arg
Pro Lys Leu Arg
Pro Lys Arg Ile
Pro Lys Arg Leu
Pro Leu Lys Arg
Pro Leu Gln Arg
Pro Leu Arg Lys
Pro Leu Arg Gln
Pro Gln Ile Arg
Pro Gln Leu Arg
Pro Gln Arg Ile
Pro Gln Arg Leu
Pro Arg Ile Lys
Pro Arg Ile Gln
Pro Arg Lys Ile
Pro Arg Lys Leu
Pro Arg Leu Lys
Pro Arg Leu Gln
Pro Arg Gln Ile
Pro Arg Gln Leu
Gln Ile Pro Arg
Gln Ile Arg Pro
Gln Leu Pro Arg
Gln Leu Arg Pro
Gln Pro Ile Arg
Gln Pro Leu Arg
Gln Pro Arg Ile
Gln Pro Arg Leu
Gln Arg Ile Pro
Gln Arg Leu Pro
Gln Arg Pro Ile
Gln Arg Pro Leu
Arg Ile Lys Pro
Arg Ile Pro Lys
Arg Ile Pro Gln
Arg Ile Gln Pro
Arg Lys Ile Pro
Arg Lys Leu Pro
Arg Lys Pro Ile
Arg Lys Pro Leu
Arg Leu Lys Pro
Arg Leu Pro Lys
Arg Leu Pro Gln
Arg Leu Gln Pro
Arg Pro Ile Lys
Arg Pro Ile Gln
Arg Pro Lys Ile
Arg Pro Lys Leu
Arg Pro Leu Lys
Arg Pro Leu Gln
Arg Pro Gln Ile
Arg Pro Gln Leu
Arg Gln Ile Pro
Arg Gln Leu Pro
Arg Gln Pro Ile
Arg Gln Pro Leu
Thr His Lys Lys
Thr Lys His Lys
Thr Lys Lys His
(E)-2-methyl-4-((3aS)-1-methyl-2,3,8,8a-tetrahydropyrrolo[2,3-b]indol-3a(1H)-yl)but-2-en-1-yl (E)-2-methyl-4-((3aS)-1-methyl-2,3,8,8a-tetrahydropyrrolo[2,3-b]indol-3a(1H)-yl)but-2-enoate
PG(18:0/0:0)[U]
3-Acetyl-11-keto-β-boswellic Acid
AKBA (Acetyl-11-keto-β-boswellic acid) is an active triterpenoid compound from the extract of Boswellia serrate and a novel Nrf2 activator. AKBA (Acetyl-11-keto-β-boswellic acid) is an active triterpenoid compound from the extract of Boswellia serrate and a novel Nrf2 activator. AKBA (Acetyl-11-keto-β-boswellic acid) is an active triterpenoid compound from the extract of Boswellia serrate and a novel Nrf2 activator.
11a,12a-Epoxy-3b-hydroxy-28,13-oleananolide 3-acetate
3b-Acetoxy-12-oxo-28,13b-oleananolide
ganoderic acid S
Ganoderic acid Mf
Glyuranolide
Menaquinone-5
butyl 1-[(E,1R,4R)-4-[(1R,3aS,4E,7aR)-4-[(2Z)-2-[(3S,5R)-3,5-dihydroxy-2-methylidenecyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-1-hydroxypent-2-enyl]cyclopropane-1-carboxylate
D018977 - Micronutrients > D014815 - Vitamins > D004100 - Dihydroxycholecalciferols D018977 - Micronutrients > D014815 - Vitamins > D006887 - Hydroxycholecalciferols
rubiarbonone E 19-acetate
A pentacyclic triterpenoid of the class of arborinane-type terpenoids isolated from the roots of Rubia yunnanensis.
[(2R)-1-[2,3-dihydroxypropoxy(hydroxy)phosphoryl]oxy-3-hydroxypropan-2-yl] octadecanoate
[(5R,6E,8E,10E,13S,14R,15R,16Z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] (2R)-2-aminopropanoate
[(3S,5S,8S,9S,10R,13S,14S,17R)-17-[(2S,3S,5S)-3-hydroxy-5,6-dimethylheptan-2-yl]-10,13-dimethyl-6-oxo-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] hydrogen sulfate
(E)-5-acetyloxy-6-(3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-methylhept-2-enoic acid
[3-carboxy-2-[(E)-7-[4,6-dihydroxy-2-[(1E,5E)-3-hydroxyocta-1,5-dienyl]oxan-3-yl]hept-5-enoyl]oxypropyl]-trimethylazanium
[(1R)-7-methoxy-2-[(3-methoxyphenyl)methyl]-1-(2-pyridinylmethyl)-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4-piperidine]yl]methanol
1-[(5S,6R,9R)-8-(cyclopropylmethyl)-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-(2-fluorophenyl)urea
[(E)-[(1R,4aR,4bS,8aS,10aS)-1-[2-[(2S,5R)-2,5-dimethoxy-2,5-dihydrofuran-3-yl]ethyl]-4b,8,8,10a-tetramethyl-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-2-ylidene]methyl] hydrogen sulfate
1-[(2R,3S)-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]-3-(4-fluorophenyl)urea
1-[(5R,6R,9R)-8-(cyclopropylmethyl)-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-(2-fluorophenyl)urea
1-[(5S,6S,9S)-8-(cyclopropylmethyl)-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-(2-fluorophenyl)urea
N-[(3R,9S,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-pyridinecarboxamide
1-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)methyl-methylamino]methyl]-3-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]-2-[[(4-methoxyphenyl)methyl-methylamino]methyl]-3-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]-2-[[(4-methoxyphenyl)methyl-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea
N-[(3R,9S,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-pyridinecarboxamide
N-[(3S,9R,10R)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-pyridinecarboxamide
1-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)methyl-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea
N-[(3S,9R,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-pyridinecarboxamide
N-[(3R,9S,10S)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-pyridinecarboxamide
N-[(3S,9S,10S)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-pyridinecarboxamide
[(1S)-7-methoxy-2-[(3-methoxyphenyl)methyl]-1-(2-pyridinylmethyl)-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4-piperidine]yl]methanol
Dereplicator Identification-Monogalactosylmonoacylglycerol;_Hemolysi
1-[(2S,3R)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-(4-fluorophenyl)urea
1-[(2S,3S)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-(4-fluorophenyl)urea
1-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)methyl-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea
N-[(3R,9S,10R)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-pyridinecarboxamide
N-[(3S,9R,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-pyridinecarboxamide
1-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)methyl-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea
N-[(3S,9R,10S)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-pyridinecarboxamide
1-[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)methyl-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea
N-[(3R,9R,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-pyridinecarboxamide
N-[(3R,9R,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-pyridinecarboxamide
N-[(3R,9R,10R)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-pyridinecarboxamide
N-[(3S,9S,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-pyridinecarboxamide
1-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)methyl-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea
1-(3-methoxyphenyl)-3-[(5R,6R,9S)-5-methoxy-3,6,9-trimethyl-2-oxo-8-propyl-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea
1-[(5R,6R,9S)-8-(cyclopropylmethyl)-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-(2-fluorophenyl)urea
[(2S)-2-hydroxy-3-[(2E,6E,10E,14E)-3,7,11,15,19-pentamethylicosa-2,6,10,14,18-pentaenoxy]propyl] dihydrogen phosphate
2,3-Dihydroxypropyl (2-hydroxy-3-nonadecoxypropyl) hydrogen phosphate
[3-[3-acetyloxy-2-[(9Z,12Z)-hexadeca-9,12-dienoyl]oxypropoxy]-1-carboxypropyl]-trimethylazanium
2-[carboxy-[2-hydroxy-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxypropoxy]methoxy]ethyl-trimethylazanium
1-octadecanoyl-sn-glycero-3-phospho-(1-sn-glycerol)
24-epi-cathasterone-22-O-sulfate
A brassinosteroid that is 24-epi-cathasterone on which the hydroxy hydrogen at position 22 has been replaced by a sulfo group.
eurysterol B sulfonic acid
A steroid sulfate that is 5alpha-cholestane with a double bond at position 22, hydroxy groups at positions 5 and 6, a bridged oxolane between positions 8 and 19 and a sulfate group at position 3.
BisMePA(22:5)
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(1s,4s,5r,8r,10r,11r,13r,14r,18s,19s,20r)-10-hydroxy-4,5,9,9,13,19,20-heptamethyl-23-oxo-24-oxahexacyclo[17.3.2.0¹,¹⁸.0⁴,¹⁷.0⁵,¹⁴.0⁸,¹³]tetracos-16-en-11-yl acetate
(3z)-3-{4-[2,3-dihydroxy-2-methyl-5-(prop-1-en-2-yl)cyclopentyl]but-3-en-2-ylidene}-3a,6,6,9a-tetramethyl-2-oxo-octahydrocyclopenta[a]naphthalen-7-yl acetate
9-[(acetyloxy)methyl]-2,2,6a,6b,9,12a-hexamethyl-10-oxo-4,5,6,7,8,8a,11,12,12b,13,14,14a-dodecahydro-3h-picene-4a-carboxylic acid
methyl 11-hydroxy-2,6,10,10,14,21-hexamethyl-16,22-dioxo-23-oxahexacyclo[19.2.1.0²,¹⁹.0⁵,¹⁸.0⁶,¹⁵.0⁹,¹⁴]tetracos-17-ene-5-carboxylate
(5s)-10-[(3z,3as,5ar,6s,7r,9ar,9bs)-7-hydroxy-6-(hydroxymethyl)-3a,6,9a-trimethyl-2-oxo-octahydrocyclopenta[a]naphthalen-3-ylidene]-2,6-dimethylundeca-2,6,8-trien-5-yl acetate
(2e)-4-(2-{[1-hydroxy-3-methyl-2-(methylamino)-3-(1-methylindol-3-yl)butylidene]amino}-n,3-dimethylbutanamido)-2,5-dimethylhex-2-enoic acid
(2e,6r)-6-[(1r,3s,3ar,7r,9as,11ar)-3-(acetyloxy)-7-hydroxy-3a,6,6,9a,11a-pentamethyl-1h,2h,3h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methylhept-2-enoic acid
(2s,6r)-6-[(3as,3bs,5ar,7r,9as,11as)-7-(acetyloxy)-3a,6,6,9a,11a-pentamethyl-3h,3bh,4h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methyl-4-oxoheptanoic acid
(2r)-2-[(1r,3s,3ar,9as,11ar)-3-(acetyloxy)-3a,6,6,9a,11a-pentamethyl-7-oxo-1h,2h,3h,4h,5h,5ah,8h,9h,10h,11h-cyclopenta[a]phenanthren-1-yl]-6-methylhept-5-enoic acid
9-benzyl-1,4,7-trihydroxy-6,6-dimethyl-3-(6-oxooctyl)-3h,9h,12h,13h,14h,14ah-pyrrolo[1,2-a]1,4,7,10-tetraazacyclododecan-10-one
6-[11-(acetyloxy)-7-hydroxy-3a,6,6,9a,11a-pentamethyl-1h,2h,3h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methylhept-2-enoic acid
3a,5a,7,8-tetrahydroxy-9a,11a-dimethyl-1-(2,3,5,6-tetrahydroxy-6-methylheptan-2-yl)-1h,2h,3h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-5-one
(1s,3r)-3-[(3ar,3bs,5as,9ar,9bs)-3a,3b,6,6,9a-pentamethyl-2,7-dioxo-3h,4h,5h,5ah,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-1-[(2r)-3,3-dimethyloxiran-2-yl]butyl acetate
(3e,3as,5ar,7s,9ar,9bs)-3-[(3e)-4-[(1s,2r,3r,5r)-2,3-dihydroxy-2-methyl-5-(prop-1-en-2-yl)cyclopentyl]but-3-en-2-ylidene]-3a,6,6,9a-tetramethyl-2-oxo-octahydrocyclopenta[a]naphthalen-7-yl acetate
6-[3-(acetyloxy)-7-hydroxy-3a,6,6,9a,11a-pentamethyl-1h,2h,3h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methylhept-2-enoic acid
(2's,3r,5as,5br,7ar,8s,11ar,11br,13s,13as)-2',3,5b,11a,13a-pentamethyl-1-oxo-4,5,5a,6,7,7a,9,10,11,11b,12,13-dodecahydro-3h-spiro[chryseno[1,2-c]furan-8,1'-cyclopropan]-13-yl 3-hydroxypentanoate
2-[7-(acetyloxy)-2-hydroxy-3a,6,6,9a,11a-pentamethyl-1h,2h,3h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-6-methylhept-5-enoic acid
3-(7-hydroxy-6,10-dimethylundeca-3,5,9-trien-2-ylidene)-6-(hydroxymethyl)-3a,6,9a-trimethyl-2-oxo-octahydrocyclopenta[a]naphthalen-7-yl acetate
[(1r,3as,3bs,5s,5as,7s,9as,11ar)-5-hydroxy-1-[(2r)-5-hydroxy-6-methyl-4-oxoheptan-2-yl]-9a,11a-dimethyl-1h,2h,3h,3ah,3bh,4h,5h,5ah,6h,7h,8h,9h,11h-cyclopenta[a]phenanthren-7-yl]oxidanesulfonic acid
(1s,2r,5s,7r,9s,10s,15r,16r)-5-(acetyloxy)-15-[(2r,3e,5r)-5,6-dimethylhept-3-en-2-yl]-2,16-dimethyl-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadec-11-en-10-yl acetate
(2e,6r)-6-[(1r,3s,3ar,5ar,9as,11ar)-3-(acetyloxy)-3a,6,6,9a,11a-pentamethyl-7-oxo-1h,2h,3h,4h,5h,5ah,8h,9h,10h,11h-cyclopenta[a]phenanthren-1-yl]-2-methylhept-2-enoic acid
(1s,2r,5s,7r,9s,10s,15r,16r)-5-(acetyloxy)-2,16-dimethyl-15-[(2r)-6-methyl-5-methylideneheptan-2-yl]-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadec-11-en-10-yl acetate
(2s,6r)-6-[(3as,3bs,5ar,7s,9as,11as)-7-(acetyloxy)-3a,6,6,9a,11a-pentamethyl-3h,3bh,4h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methyl-4-oxoheptanoic acid
5-(acetyloxy)-6-{7-hydroxy-3a,6,6,9a,11a-pentamethyl-1h,2h,3h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl}-2-methylhept-2-enoic acid
12α-acetoxycoccinic acid
{"Ingredient_id": "HBIN000702","Ingredient_name": "12\u03b1-acetoxycoccinic acid","Alias": "12\u03b1-acetoxycoccinicacid","Ingredient_formula": "C32H48O5","Ingredient_Smile": "C32H48O5","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "34201;144","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
12β-acetoxycoccinic acid
{"Ingredient_id": "HBIN000746","Ingredient_name": "12\u03b2-acetoxycoccinic acid","Alias": "12\u03b2-acetoxycoccinicacid","Ingredient_formula": "C32H48O5","Ingredient_Smile": "C32H48O5","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "34199;145","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(24z)-3-oxo-12α-acetoxylanosta-8,24-dien-26-oic acid
{"Ingredient_id": "HBIN004561","Ingredient_name": "(24z)-3-oxo-12\u03b1-acetoxylanosta-8,24-dien-26-oic acid","Alias": "(24z)-3-oxo-12\u03b1-acetoxylanosta-8,24-dien-26-oicacid","Ingredient_formula": "C32H48O5","Ingredient_Smile": "C32H48O5","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "41342;16279","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(25r)-3β-acetoxy-23-oxo-9,16-lanostandien-26-oicacid
{"Ingredient_id": "HBIN004731","Ingredient_name": "(25r)-3\u03b2-acetoxy-23-oxo-9,16-lanostandien-26-oicacid","Alias": "NA","Ingredient_formula": "C32H48O5","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "274","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3β-hydroxy-16α-acetoxy-lanosta-7,9(11),24-trien-21-oicacid
{"Ingredient_id": "HBIN008221","Ingredient_name": "3\u03b2-hydroxy-16\u03b1-acetoxy-lanosta-7,9(11),24-trien-21-oicacid","Alias": "3beta-hydroxy-16alpha-acetoxy-lanosta7,9(11),24-trien-21-oic acid","Ingredient_formula": "C32H48O5","Ingredient_Smile": "CC(CCC=C(C)C(=O)O)C1CC(C2(C1(CC=C3C2=CCC4C3(CCC(C4(C)C)O)C)C)C)OC(=O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT15799","TCMID_id": "9757;31137","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3-o-acetyl-glycyrrhetinicacid
{"Ingredient_id": "HBIN009025","Ingredient_name": "3-o-acetyl-glycyrrhetinicacid","Alias": "NA","Ingredient_formula": "C32H48O5","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14141","TCMID_id": "403","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
acetyl-11-keto-β-boswellicacid
{"Ingredient_id": "HBIN014439","Ingredient_name": "acetyl-11-keto-\u03b2-boswellicacid","Alias": "acetyl 11-keto-\u03b2-boswellic acid","Ingredient_formula": "C32H48O5","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14150","TCMID_id": "444;36048","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}