Exact Mass: 406.258
Exact Mass Matches: 406.258
Found 500 metabolites which its exact mass value is equals to given mass value 406.258
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
7-Ketodeoxycholic acid
7-Ketodeoxycholic acid is a bile acid. Bile acids are steroid acids found predominantly in the bile of mammals. The distinction between different bile acids is minute, depending only on the presence or absence of hydroxyl groups on positions 3, 7, and 12. Bile acids are physiological detergents that facilitate excretion, absorption, and transport of fats and sterols in the intestine and liver. Bile acids are also steroidal amphipathic molecules derived from the catabolism of cholesterol. They modulate bile flow and lipid secretion, are essential for the absorption of dietary fats and vitamins, and have been implicated in the regulation of all the key enzymes involved in cholesterol homeostasis. Bile acids recirculate through the liver, bile ducts, small intestine and portal vein to form an enterohepatic circuit. They exist as anions at physiological pH and, consequently, require a carrier for transport across the membranes of the enterohepatic tissues. The unique detergent properties of bile acids are essential for the digestion and intestinal absorption of hydrophobic nutrients. Bile acids have potent toxic properties (e.g. membrane disruption) and there are a plethora of mechanisms to limit their accumulation in blood and tissues (PMID: 11316487, 16037564, 12576301, 11907135). 7-Ketodeoxycholic acid is a bile acid. Bile acids are steroid acids found predominantly in bile of mammals. The distinction between different bile acids is minute, depends only on presence or absence of hydroxyl groups on positions 3, 7, and 12. D005765 - Gastrointestinal Agents > D001647 - Bile Acids and Salts D005765 - Gastrointestinal Agents > D002793 - Cholic Acids 7-keto-lithocholic acid is a metabolite of bile acids in Clostridium absonum. 7-keto-lithocholic acid is also converted from Lactobacillus and Bifidobacterium with specific condition[1][2].
3,7-Dihydroxy-12-oxocholanoic acid
3,7-Dihydroxy-12-oxocholanoic acid is a bile acid. Bile acids are steroid acids found predominantly in the bile of mammals. The distinction between different bile acids is minute, depending only on the presence or absence of hydroxyl groups on positions 3, 7, and 12. Bile acids are physiological detergents that facilitate excretion, absorption, and transport of fats and sterols in the intestine and liver. Bile acids are also steroidal amphipathic molecules derived from the catabolism of cholesterol. They modulate bile flow and lipid secretion, are essential for the absorption of dietary fats and vitamins, and have been implicated in the regulation of all the key enzymes involved in cholesterol homeostasis. Bile acids recirculate through the liver, bile ducts, small intestine and portal vein to form an enterohepatic circuit. They exist as anions at physiological pH and, consequently, require a carrier for transport across the membranes of the enterohepatic tissues. The unique detergent properties of bile acids are essential for the digestion and intestinal absorption of hydrophobic nutrients. Bile acids have potent toxic properties (e.g. membrane disruption) and there are a plethora of mechanisms to limit their accumulation in blood and tissues (PMID: 11316487, 16037564, 12576301, 11907135). A bile acid. Bile acids are steroid acids found predominantly in bile of mammals. The distinction between different bile acids is minute, depends only on presence or absence of hydroxyl groups on positions 3, 7, and 12. D005765 - Gastrointestinal Agents > D001647 - Bile Acids and Salts D005765 - Gastrointestinal Agents > D002793 - Cholic Acids
Nandrolone phenpropionate
Nandrolone phenpropionate is only found in individuals that have used or taken this drug. It is a C18 steroid with androgenic and anabolic properties. It is generally prepared from alkyl ethers of estradiol to resemble testosterone but less one carbon at the 19 position. It is a schedule III drug in the U.S. Nandrolone is an androgen receptor agonist. The drug bound to the receptor complexes which allows it to enter the nucleus and bind directly to specific nucleotide sequences of the chromosomal DNA. The areas of binding are called hormone response elements (HREs), and influence transcriptional activity of certain genes, producing the androgen effects. D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D045930 - Anabolic Agents C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
3-Oxocholic acid
3-Oxocholic acid, also known as 7alpha,12alpha-dihydroxy-3-oxo-5beta-cholan-24-oic acid, is a bile acid. Bile acids are steroid acids found predominantly in the bile of mammals. The distinction between different bile acids is minute, depending only on the presence or absence of hydroxyl groups on positions 3, 7, and 12. 3-Oxocholic acid is considered to be practically insoluble (in water) and acidic. D005765 - Gastrointestinal Agents > D001647 - Bile Acids and Salts D005765 - Gastrointestinal Agents > D002793 - Cholic Acids 3-Oxocholic acid is an oxo-bile acid metabolite and also a major degradation product from cholic by C. perfringens in the intestine. 3-Oxocholic acid is steroid acid found predominantly in bile of mammals[1][2][3].
Annoglabasin C
Annoglabasin C is found in alcoholic beverages. Annoglabasin C is a constituent of Annona glabra (pond apple) Constituent of Annona glabra (pond apple). Annoglabasin C is found in alcoholic beverages and fruits.
(6b,7b,13R)-6,7-Diacetoxy-8,14-labdadiene-13-ol
(6b,7b,13R)-6,7-Diacetoxy-8,14-labdadiene-13-ol is found in fruits. (6b,7b,13R)-6,7-Diacetoxy-8,14-labdadiene-13-ol is a constituent of Vitex agnus-castus (agnus castus). Constituent of Vitex agnus-castus (agnus castus). (6b,7b,13R)-6,7-Diacetoxy-8,14-labdadiene-13-ol is found in herbs and spices and fruits.
Annocherin A
Annocherin A is found in fruits. Annocherin A is a constituent of Annona cherimola (cherimoya).
Alfaprostolum
Pravastatin lactone
Methyl ent-16-acetoxy-6alpha-hydroxy-17-oxo-7,13E-labdadien-15-oate
Methyl ent-16-acetoxy-8beta-formyl-8-desmethyl-6,13E-labdadien-15-oate
(17alpha)-3,5,14,19-tetrahydroxycard-20(22)-enolide
Methyl ent-16-acetoxy-6beta-hydroxy-17-oxo-7,13E-labdadien-15-oate
11alpha-Acetoxy-3beta,12beta,14-trihydroxy-14beta-pregn-5-en-20-on|11alpha-acetoxy-3beta,12beta,14-trihydroxy-14beta-pregn-5-en-20-one|Drevogenin B; 11-O-Acetyl-drevogenin P
15,16-Di-Ac-(8alpha,12R,13E)-8,12-Epoxy-13-labdene-15,16-diol
methyl-1alpha-acetoxy-7alpha,14alpha-dihydroxy-8,15-isopimaradien-18-oate
2beta-acetoxy-19-carboxymethyl-cleroda-3,13-dien-15-oic acid
8beta-hydroxy-11alpha,12beta-diacetoxypimar-16-ene
(ent-13E)-19-Succinoyl 3,13-Clerodadiene-15,19-diol|vanclevic acid B
14,17-Di-Ac-(17R)-8,10,13(15)-Lobatriene-14,17,18-triol|Loba-8,10,13(15)-trien-14,17,18-triol-14,17-diacetat
3alpha,15-diacetoxy-11-hydroxy-ent-labda-7,13-diene
2beta,15-diacetoxy-3beta-hydroxy-ent-labd-7,13E-diene
methyl 14alpha-acetoxy-7alpha,11alpha-dihydroxy-8,15-isopimaradien-18-oate
8-Hydroxy-3-(12-phenyldodecyl)-1H-2-benzopyran-1-one
methyl 3alpha-acetoxy-13xi,14xi-epoxy-15-oxo-labd-8(17)-en-19-oate
methyl 7alpha-acetoxy-8beta,14beta-diformylpodocarpane-13beta-carboxylate
rac-4,6-dihydroxy-2-(2-oxoheptadecyl) benzoic acid
19-O-acetyl-3beta,12beta,14beta,19-tetrahydroxypregn-5-en-20-one|sakuragenin
5-|A-PREGNAN-3-|A, 17,21-TRIOL-11,20-DIONE 3-ACETATE
(20S*)-14beta-acetoxy-1alpha,15beta-dihydroxy-20-methoxy-7alpha,20-epoxy-ent-kaur-16-ene|rubluanin A
3beta,5alpha,14beta,17beta-tetrahydroxycard-20(22)-enolide
12beta-O-acetyl-15alpha,17beta-dihydroxy-3-oxo-20,21,22-23,24,25,26,27-octanordammanran
loba-8,10,13(15)-trien-16,17,18-triol-16,17-diacetate
10,18-Diacetoxy-8-hydroxy-2,6-dolabelladien|10,18-Diacetoxy-8-hydroxy-2,6-dolabelladiene
6alpha-(2-Methylpropanoyloxy)-7-Oxo-3-cleroden-15-oic acid
dimethyl (2E,6E,10Z,14Z)-6-methoxycarbonyl-2,10,14-trimethylhexadeca-2,6,10,14-tetraenedioate
loba-8,10,15-triene-13,17,18-triol-17,18-diacetate
diacetyldistanol|ent-7alpha,18-diacetoxy-16beta-hydroxykaurane
Ajugarin IV|ajugarin-IV|Me ester,Ac-6-Hydroxy-13-cleroden-15,16-olid-18-oic acid
(1R,6R,11R,12R)-6,16-diacetoxy-12-hydroxydolabella-3E,7E-diene
methyl 7alpha-acetoxy-11alpha,14alpha-dihydroxy-8,15-isopimaradien-18-oate
2alpha,3alpha-diacetoxy-4beta-hydroxy-3,4-dihydrokolavenol acetate
methyl ent-8(R),15(S)epoxy-12beta-acetoxy-16-hydroxypimar-9(11)-en-19-oate
5-Oxo,6-hydroxy,6-Me ether-(R)-3,4-Dihydro-6,8-dihydroxy-3-tridecyl-1H-2-benzopyran-1-one
16-Hydroxy 6,16-Di-Ac-(1R,3E,6R,7E,11R,12R)-3,7-Dolabelladiene-6,12-diol
(3E,11E)-6,15-diacetoxy-7,8-epoxycembra-3,11-diene|6-acetoxy-7,8-epoxynephthenol acetate
Bipindogenin
D020011 - Protective Agents > D002316 - Cardiotonic Agents > D002301 - Cardiac Glycosides
(2E,4E)-cyclo-[(NMe-L-Ala)-(NMe-L-Val)-(Nalpha-hexa-2,4-dienoyl-L-Orn)]|sclerotiotide B
(+)-(1R*,3E,7E,9R*,11R*,12R*)-9,16-acetoxydolabella-3,7-dien-12-ol
[1-acetyloxy-4-(3-hydroxy-3-methylpent-4-enyl)-3,4,8,8-tetramethyl-1,2,3,5,6,7-hexahydronaphthalen-2-yl] acetate
7-Ketodeoxycholic acid
D005765 - Gastrointestinal Agents > D001647 - Bile Acids and Salts D005765 - Gastrointestinal Agents > D002793 - Cholic Acids CONFIDENCE standard compound; INTERNAL_ID 265 7-keto-lithocholic acid is a metabolite of bile acids in Clostridium absonum. 7-keto-lithocholic acid is also converted from Lactobacillus and Bifidobacterium with specific condition[1][2].
3-Oxocholic acid
CONFIDENCE standard compound; INTERNAL_ID 302 3-Oxocholic acid is an oxo-bile acid metabolite and also a major degradation product from cholic by C. perfringens in the intestine. 3-Oxocholic acid is steroid acid found predominantly in bile of mammals[1][2][3].
(4R,E)-4-((3R,5R,6S,7R,9S,10R,13R,14S,17R)-3,6,7-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pent-2-enoic acid
(4R)-4-((3S,5S,7S,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-12-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid
(R)-4-((3S,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-12-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid
(4R)-4-((5S,7R,8R,9S,10S,12S,13R,17R)-7,12-dihydroxy-10,13-dimethyl-3-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid
(22E)-3α,6β,7β-Trihydroxy-5β-chol-22-en-24-oic Acid
(22E)-3α,7α,12α-Trihydroxy-5β-chol-22-en-24-oic Acid
3α,12α,15β-Trihydroxy-5β-chol-8(14)-en-24-oic Acid
3,7-Dihydroxy-12-oxocholanoic acid
D005765 - Gastrointestinal Agents > D001647 - Bile Acids and Salts D005765 - Gastrointestinal Agents > D002793 - Cholic Acids
3-Oxocholic acid
A bile acid. Bile acids are steroid acids found predominantly in bile of mammals. The distinction between different bile acids is minute, depends only on presence or absence of hydroxyl groups on positions 3, 7, and 12. [HMDB] 3-Oxocholic acid is an oxo-bile acid metabolite and also a major degradation product from cholic by C. perfringens in the intestine. 3-Oxocholic acid is steroid acid found predominantly in bile of mammals[1][2][3].
3alpha,7alpha-Dihydroxy-22-oxo-5beta-cholan-24-oic Acid
Annocherin A
(6b,7b,13R)-6,7-Diacetoxy-8,14-labdadiene-13-ol
Annoglabasin C
ST 24:2;O5
D005765 - Gastrointestinal Agents > D001647 - Bile Acids and Salts D005765 - Gastrointestinal Agents > D002793 - Cholic Acids 3-Oxocholic acid is an oxo-bile acid metabolite and also a major degradation product from cholic by C. perfringens in the intestine. 3-Oxocholic acid is steroid acid found predominantly in bile of mammals[1][2][3].
5-methoxy-3-(2R-acetoxy-pentadecyl)-1,4-benzoquinone
Calcium bis[(3Z)-2,2,6,6-tetramethyl-5-oxo-3-hepten-3-olate]
ethane-1,2-diamine,ethyl prop-2-enoate,trimethoxy-[2-(7-oxabicyclo[4.1.0]heptan-4-yl)ethyl]silane
Testosterone phenylacetate
C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C2360 - Anabolic Steroid
Cyclopropanecarboxylic acid, 2-ethenyl-1-[[[(1R,2R,4S)-2-[(5-hexen-1-ylmethylamino)carbonyl]-4-hydroxycyclopentyl]carbonyl]amino]-, ethyl ester, (1R,2S)
TERT-BUTYL ((S)-2-(((BENZYLOXY)CARBONYL)AMINO)-3-((R)-TETRAHYDRO-2H-PYRAN-3-YL)PROPYL)(METHYL)CARBAMATE
Card-20(22)-enolide,3,5,14,19-tetrahydroxy-, (3b,5b)-
2,2-bis(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)biphenyl
3,3-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,1-biphenyl
(1R,2S)-2-Ethenyl-1-[[[(1R,2R,4R)-2-[(6-hepten-1-ylamino)carbonyl]-4-hydroxycyclopentyl]carbonyl]amino]cyclopropanecarboxylic acid ethyl ester
bis(2,2,6,6-tetramethyl-3,5-heptanedionato)calcium(ii)
Methyl (E)-7-[2-(5-cyclohexyl-3-hydroxypent-1-ynyl)-3,5-dihydroxycyclopentyl]hept-5-enoate
vitetrifolin d
A labdane diterpenoid that is isolated from the fruits of Vitex trifolia L and Vitex negundo.
4-(7,12-Dihydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)pentanoic acid
[1-Acetyloxy-4-(3-hydroxy-3-methylpent-4-enyl)-3,4,8,8-tetramethyl-1,2,3,5,6,7-hexahydronaphthalen-2-yl] acetate
[(1S,3R,7S,8S,8aR)-3-hydroxy-8-[2-[(4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-7-methyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] (2S)-2-methylbutanoate
Tritoniopsin A, rel-
A natural product found in Tritoniopsis elegans and Cladiella krempfi.
1-(2-Methoxyphenyl)-4-[(4-methylphenyl)-(1-propan-2-yl-5-tetrazolyl)methyl]piperazine
N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]alaninate
An N-acyl-L-alpha-amino acid anion that is the conjugate base of N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]alanine, obtained by deprotonation of the carboxy group; major species at pH 7.3.
N-[(15S)-hydroperoxy-(5Z,8Z,11Z,13E)-icosatetraenoyl]alaninate
An N-acyl-L-alpha-amino acid anion that is the conjugate base of N-[(15S)-hydroperoxy-(5Z,8Z,11Z,13E)-icosatetraenoyl]alanine, obtained by deprotonation of the carboxy group; major species at pH 7.3.
1-[(4S,7S,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propan-2-ylurea
4-(4-hydroxy-2,6-dimethylheptan-4-yl)-N,N-diphenyl-1-triazolecarboxamide
1-[(5R,6R,9S)-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-propan-2-ylurea
1-[(5R,6R,9R)-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-propan-2-ylurea
1-[(4R,7R,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propylurea
1-[(4S,7S,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propylurea
1-[(4R,7S,8S)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propylurea
1-[(2R,3S)-2-[(dimethylamino)methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea
1-[(2S,3R)-2-[(dimethylamino)methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea
1-[(2R,3R)-2-[(dimethylamino)methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea
1-[(4S,7R,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propylurea
1-[(4R,7S,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propylurea
1-[(4S,7S,8S)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propylurea
1-[(4S,7R,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propan-2-ylurea
1-[(4R,7S,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propan-2-ylurea
1-[(5R,6S,9R)-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-propan-2-ylurea
1-[(5S,6S,9S)-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-propylurea
1-[(5S,6S,9R)-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-propylurea
1-[(5S,6R,9S)-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-propylurea
[(1R)-7-methoxy-9-methyl-1-(pyridin-4-ylmethyl)-1-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,4-piperidine]yl]methanol
1-[(2R,3R)-2-[(dimethylamino)methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea
1-[(2R,3S)-2-[(dimethylamino)methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea
1-[(2S,3S)-2-[(dimethylamino)methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea
1-[(2S,3R)-2-[(dimethylamino)methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea
1-[(2S,3S)-2-[(dimethylamino)methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea
1-[(2R,3S)-2-[(dimethylamino)methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-propan-2-ylurea
1-[(2S,3R)-2-[(dimethylamino)methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-propan-2-ylurea
1-[(2S,3S)-2-[(dimethylamino)methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-propan-2-ylurea
1-[(2S,3R)-2-[(dimethylamino)methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-propan-2-ylurea
1-[(4S,7R,8S)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propylurea
1-[(4S,7S,8S)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propan-2-ylurea
1-[(4R,7R,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propan-2-ylurea
1-[(4R,7S,8S)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propan-2-ylurea
1-[(4S,7R,8S)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propan-2-ylurea
1-[(5S,6S,9S)-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-propan-2-ylurea
1-[(5S,6S,9R)-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-propan-2-ylurea
1-[(5S,6R,9S)-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-propan-2-ylurea
1-[(5R,6R,9R)-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-propylurea
1-[(5R,6R,9S)-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-propylurea
1-[(5R,6S,9S)-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-propylurea
1-[(5R,6S,9R)-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-propylurea
[(1S)-7-methoxy-9-methyl-1-(pyridin-4-ylmethyl)-1-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,4-piperidine]yl]methanol
4-[(3R,5S,7R)-3,7-dihydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
(1-hydroxy-3-pentanoyloxypropan-2-yl) (4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoate
(1-hydroxy-3-propanoyloxypropan-2-yl) (6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoate
2-[Carboxy-(3-decanoyloxy-2-hydroxypropoxy)methoxy]ethyl-trimethylazanium
Nandrolone phenpropionate
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D045930 - Anabolic Agents C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone
7alpha,12alpha-Dihydroxy-3-oxo-5beta-cholan-24-oic acid
A 3-oxo steroid that is cholic acid in which the hydroxy group at position 3 has undergone formal oxidation to the corresponding ketone.
3alpha,7beta-Dihydroxy-12-oxo-5beta-cholan-24-oic Acid
7alpha,12alpha-Dihydroxy-3-oxo-5alpha-cholan-24-oic Acid
3beta,7alpha,12alpha-Trihydroxychol-5-en-24-oic Acid
(22E)-3alpha,6beta,7beta-Trihydroxy-5beta-chol-22-en-24-oic Acid
3beta,7beta-Dihydroxy-12-oxo-5beta-cholan-24-oic Acid
1-Heptadecylglycerone 3-phosphate(2-)
A 1-alkylglycerone 3-phosphate(2-) obtained by deprotonation of the phosphate OH groups of 1-heptadecylglycerone 3-phosphate; major species at pH 7.3.
3beta,7alpha-Dihydroxy-12-oxo-5beta-cholan-24-oic Acid
3alpha,7alpha,12alpha-Trihydroxy-5beta-chol-9(11)-en-24-oic Acid
3alpha,12beta-Dihydroxy-11-oxo-5beta-cholan-24-oic Acid
6alpha,7alpha-Dihydroxy-3-oxo-5beta-cholan-24-oic Acid
2beta,3beta-Dihydroxy-6-oxo-5alpha-cholan-24-oic Acid
3alpha,9alpha-Dihydroxy-11-oxo-5beta-cholan-24-oic Acid
3beta,12alpha-Dihydroxy-7-oxo-5beta-cholan-24-oic Acid
6beta,12alpha-Dihydroxy-3-oxo-5beta-cholan-24-oic Acid
3alpha,12alpha-Dihydroxy-11-oxo-5beta-cholan-24-oic Acid
3alpha,12alpha-Dihydroxy-15-oxo-5beta,14beta-cholan-24-oic Acid
3alpha,7alpha,12alpha-Trihydroxy-5alpha-chol-22-en-24-oic acid
(22E)-3alpha,7alpha,12alpha-Trihydroxy-5beta-chol-22-en-24-oic Acid
3alpha,12alpha,15beta-Trihydroxy-5beta-chol-8(14)-en-24-oic Acid
(2r)-1-(5-methoxy-3,6-dioxocyclohexa-1,4-dien-1-yl)pentadecan-2-yl acetate
methyl 9-(acetyloxy)-7-ethenyl-5,8-dihydroxy-1,4a,7-trimethyl-3,4,5,6,8,9,10,10a-octahydro-2h-phenanthrene-1-carboxylate
3-(13-hydroxytetradecyl)-5,7-dimethoxy-3h-2-benzofuran-1-one
methyl (4as,4br,7r,7ar,10ar,11r,12as)-11-(acetyloxy)-1,1,4a-trimethyl-8-oxo-dodecahydrophenanthro[8,8a-c]furan-7-carboxylate
(1e,5e)-2-[(1e)-2-(acetyloxy)ethenyl]-8-[(1r,2r)-2-hydroxy-2,6,6-trimethylcyclohexyl]-6-methylocta-1,5-dien-1-yl acetate
[(3s,6s)-6-[(2s,5r)-5-[(7z,9z)-tetradeca-7,9,13-trien-1-yl]oxolan-2-yl]-1,2-dioxan-3-yl]acetic acid
(1s,3as,3br,7s,9ar,9bs,10s,11s,11as)-1-acetyl-3a,7,11-trihydroxy-9a,11a-dimethyl-1h,2h,3h,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-10-yl acetate
methyl (1s,4s,5r,9s)-4-[1-(acetyloxy)-4-(3,3-dimethyloxiran-2-yl)but-2-en-2-yl]-1-methyl-6-methylidene-10-oxabicyclo[7.1.0]decane-5-carboxylate
4-hydroxy-5-(9-hydroxy-3,7,11-trimethyldodeca-2,6,10-trien-1-yl)-2,3-dimethoxy-6-methylcyclohex-2-en-1-one
(1s,4as,5's,8as)-5,5,5',8a-tetramethyl-2-{[(2-methylpropanoyl)oxy]methyl}-4a,6,7,8-tetrahydro-4h-spiro[naphthalene-1,2'-oxolan]-5'-ylacetic acid
5-[3-(acetyloxy)-4-hydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydronaphthalen-1-yl]-3-methylpent-2-en-1-yl acetate
(1r,4r,4as,5r,8r,11z,12as)-8-(acetyloxy)-4-hydroxy-1-isopropyl-4,11-dimethyl-7-methylidene-1,2,3,4a,5,6,8,9,10,12a-decahydrobenzo[10]annulen-5-yl acetate
methyl (3r)-5-[(1r,2s,3s,4as,8ar)-3-(acetyloxy)-7-hydroxy-1,2,4a-trimethyl-5-methylidene-6-oxo-2,3,4,8a-tetrahydronaphthalen-1-yl]-3-methylpentanoate
4-{7,11-dihydroxy-9a,11a-dimethyl-4-oxo-tetradecahydrocyclopenta[a]phenanthren-1-yl}pentanoic acid
(1s,2r,3s,4r)-2-(acetyloxy)-4-[(3s)-3-hydroxy-3-methylpent-4-en-1-yl]-3,4,8,8-tetramethyl-1,2,3,5,6,7-hexahydronaphthalen-1-yl acetate
4-{[(1s,2r,4as,8ar)-1-[(3e)-5-hydroxy-3-methylpent-3-en-1-yl]-1,2,5-trimethyl-2,3,4,7,8,8a-hexahydronaphthalen-4a-yl]methoxy}-4-oxobutanoic acid
{6-[5-(tetradeca-7,9,13-trien-1-yl)oxolan-2-yl]-1,2-dioxan-3-yl}acetic acid
(6e,8s,10e,12s,14s)-12-(acetyloxy)-14-hydroxy-2,6,10,14-tetramethylhexadeca-2,6,10,15-tetraen-8-yl acetate
6-(8-hydroxy-5,9-dimethoxy-7-methyltetradeca-1,3,9,11-tetraen-1-yl)-5-methoxy-5,6-dihydropyran-2-one
4-{4,11-dihydroxy-9a,11a-dimethyl-7-oxo-tetradecahydrocyclopenta[a]phenanthren-1-yl}pentanoic acid
1-[(1r,4ar,4br,7s,8ar,10ar)-7-ethenyl-4b-hydroxy-1,4a,7-trimethyl-decahydrophenanthren-1-yl]methyl 3-methyl propanedioate
(3r,5s)-3-[(4r)-1-hydroxy-4-methyl-3-oxohex-1-en-1-yl]-5-[(2s)-2-hydroxy-6-methylhept-5-en-2-yl]-3-(3-methylbut-2-en-1-yl)oxolan-2-one
methyl 3-[(acetyloxy)methyl]-5-[2-(formyloxy)-5,5,8a-trimethyl-1,2,4a,6,7,8-hexahydronaphthalen-1-yl]pent-2-enoate
(4bs,6as,10as,10bs)-4b,7,7,10a-tetramethyl-2-(2-sulfoethyl)-4ah,5h,6h,6ah,8h,9h,10h,10bh,11h,12h-naphtho[2,1-f]isoquinolin-4a-yl
2-[(1r,3ar,6s,10s,12s,12as)-12-(acetyloxy)-10-hydroxy-3a,6,10-trimethyl-1h,2h,3h,6h,7h,11h,12h,12ah-cyclopenta[11]annulen-1-yl]propan-2-yl acetate
4-[3a,7,11-trihydroxy-9a-(hydroxymethyl)-11a-methyl-tetradecahydrocyclopenta[a]phenanthren-1-yl]-5h-furan-2-one
(2e,5s)-5-[(1r,4as,6r,8ar)-6-(acetyloxy)-2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]-5-hydroxy-3-methylpent-2-en-1-yl acetate
(1s,2s,4as,8as)-2-(acetyloxy)-4-[(3z)-5-hydroxy-3-methylpent-3-en-1-yl]-3,4a,8,8-tetramethyl-1,2,5,6,7,8a-hexahydronaphthalen-1-yl acetate
methyl (2r,4z,8s,9e,11e)-2-hydroxy-15-[(2r)-2-hydroxy-5-oxo-2h-furan-3-yl]-4,8,12-trimethylpentadeca-4,9,11-trienoate
[(1s,2s,4r,7r,10s,12r,13r)-13-[(acetyloxy)methyl]-4,13-dihydroxy-2-methyltetracyclo[10.3.1.0¹,¹⁰.0²,⁷]hexadec-5-en-6-yl]methyl acetate
5-[7-(acetyloxy)-6-hydroxy-2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]-3-methylpent-2-en-1-yl acetate
3-[2-(1,2,4a-trimethyl-5-methylidene-hexahydro-2h-naphthalen-1-yl)-1-(acetyloxy)ethyl]-4-hydroxybut-2-en-1-yl acetate
[(3s,6s)-6-[(2s,5r)-5-[(7z,9e)-tetradeca-7,9,13-trien-1-yl]oxolan-2-yl]-1,2-dioxan-3-yl]acetic acid
2-[12-(acetyloxy)-4,10,14-trimethyl-15-oxabicyclo[12.1.0]pentadeca-4,10-dien-7-yl]propan-2-yl acetate
10,18-diacetoxy-8-hydroxy-2,6-dolabelladiene
{"Ingredient_id": "HBIN000031","Ingredient_name": "10,18-diacetoxy-8-hydroxy-2,6-dolabelladiene","Alias": "NA","Ingredient_formula": "C24H38O5","Ingredient_Smile": "CC1CC=CC(CC(C2C(CCC2(C=C1)C)C(C)(C)OC(=O)C)OC(=O)C)(C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5302","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
12-o-acetyllineolone
{"Ingredient_id": "HBIN000920","Ingredient_name": "12-o-acetyllineolone","Alias": "NA","Ingredient_formula": "C23H34O6","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "448","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
6β,7β-diacetoxy-13-hydroxy-labda-8,14-diene
{"Ingredient_id": "HBIN012243","Ingredient_name": "6\u03b2,7\u03b2-diacetoxy-13-hydroxy-labda-8,14-diene","Alias": "NA","Ingredient_formula": "C24H38O5","Ingredient_Smile": "CC1=C(C2(CCCC(C2C(C1OC(=O)C)OC(=O)C)(C)C)C)CCC(C)(C=C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5307","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
7,11,14-trihydroxy-8,15-isopimaradien-18-oic acid; (7α,11α,14α)-form,7-ac,me ester
{"Ingredient_id": "HBIN012859","Ingredient_name": "7,11,14-trihydroxy-8,15-isopimaradien-18-oic acid; (7\u03b1,11\u03b1,14\u03b1)-form,7-ac,me ester","Alias": "NA","Ingredient_formula": "C23H34O6","Ingredient_Smile": "NA","Ingredient_weight": "406.51","OB_score": "NA","CAS_id": "234078-41-2","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7498","PubChem_id": "NA","DrugBank_id": "NA"}
7α,18-diacetoxyabiet-8(14)-en-13β-ol
{"Ingredient_id": "HBIN013031","Ingredient_name": "7\u03b1,18-diacetoxyabiet-8(14)-en-13\u03b2-ol","Alias": "NA","Ingredient_formula": "C24H38O5","Ingredient_Smile": "CC(C)C1(CCC2C(=C1)C(CC3C2(CCCC3(C)COC(=O)C)C)OC(=O)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5283","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
8-hydroxy-periplogenin
{"Ingredient_id": "HBIN013788","Ingredient_name": "8-hydroxy-periplogenin","Alias": "NA","Ingredient_formula": "C23H34O6","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10598","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
bakkenolide h
{"Ingredient_id": "HBIN017538","Ingredient_name": "bakkenolide h","Alias": "NA","Ingredient_formula": "C23H34O6","Ingredient_Smile": "CC1CCC(C2C1(CC3(C2OC(=O)C(C)C)C(=C)COC3=O)C)OC(=O)C(C)C","Ingredient_weight": "406.5 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "2122","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "10740108","DrugBank_id": "NA"}
Bakkenolide-H
{"Ingredient_id": "HBIN017539","Ingredient_name": "Bakkenolide-H","Alias": "NA","Ingredient_formula": "C23H34O6","Ingredient_Smile": "CC1CCC(C2C1(CC3(C2OC(=O)C(C)C)C(=C)COC3=O)C)OC(=O)C(C)C","Ingredient_weight": "406.5 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "35674","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "10740108","DrugBank_id": "NA"}