Chemical Formula: C21H28O6
Chemical Formula C21H28O6
Found 285 metabolite its formula value is C21H28O6
12alpha-Hydroxy-13,18-dehydroparain
12alpha-Hydroxy-13,18-dehydroparain is a constituent of Quassia amara (Surinam quassia). Constituent of Quassia amara (Surinam quassia)
11,12,14-Trihydroxy-7-methoxy-8,11,13-abietatrien-20,6-olide
11,12,14-Trihydroxy-7-methoxy-8,11,13-abietatrien-20,6-olide is found in herbs and spices. 11,12,14-Trihydroxy-7-methoxy-8,11,13-abietatrien-20,6-olide is a constituent of leaves of rosemary (Rosmarinus officinalis) Constituent of leaves of rosemary (Rosmarinus officinalis). 14-Hydroxy-7-methylrosmanol is found in herbs and spices.
18-Oxocortisol
18-Oxocortisol shares structural characteristics with cortisol and aldosterone and is secreted from the adrenal cortex. The plasma levels of 18-Oxocortisol are significantly higher in patients with adrenocortical disorders than in control subjects. (PMID 8013138) [HMDB] 18-Oxocortisol shares structural characteristics with cortisol and aldosterone and is secreted from the adrenal cortex. The plasma levels of 18-Oxocortisol are significantly higher in patients with adrenocortical disorders than in control subjects. (PMID 8013138). D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
16α-hydroxyprednisolone
16α-hydroxyprednisolone is a metabolite of budesonide. Budesonide is a glucocorticoid steroid for the treatment of asthma and non-infectious rhinitis (including hay fever and other allergies), and for treatment and prevention of nasal polyposis. In addition, it is used for Crohns disease. (Wikipedia)
16alpha-Hydroxyprednisolone
beta-hydroxyprednisolone
1,7-bis-(4-Hydroxy-3-methoxyphenyl)-heptane-3,5-diol
1,7-bis-(4-hydroxy-3-methoxyphenyl)-heptane-3,5-diol is a member of the class of compounds known as curcuminoids. Curcuminoids are aromatic compounds containing a curcumin moiety, which is composed of two aryl buten-2-one (feruloyl) chromophores joined by a methylene group. 1,7-bis-(4-hydroxy-3-methoxyphenyl)-heptane-3,5-diol is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 1,7-bis-(4-hydroxy-3-methoxyphenyl)-heptane-3,5-diol can be found in ginger, which makes 1,7-bis-(4-hydroxy-3-methoxyphenyl)-heptane-3,5-diol a potential biomarker for the consumption of this food product.
YS2A8X6SX2
Octahydrocurcumin is a natural product found in Zingiber officinale with data available. Octahydrocurcumin is a hydrogenated derivative of curcumin and a metabolite of curcumin. Octahydrocurcumin is a hydrogenated derivative of curcumin and a metabolite of curcumin.
4beta-Hydroxy-3alpha,6alpha,15,16-bis-epoxy-cis-clerodane-13(16),14-dien-20,12-olide
1,7-Bis(4-hydroxy-3-methoxyphenyl)-3,5-heptanediol
11,12,14-Trihydroxy-7-methoxy-8,11,13-abietatrien-20,6-olide
Octahydrocurcumin
Octahydrocurcumin is a hydrogenated derivative of curcumin and a metabolite of curcumin. Octahydrocurcumin is a hydrogenated derivative of curcumin and a metabolite of curcumin.
8-hydroxy-2,7,7,11,15-pentamethyl-5,12,16-trioxapentacyclo[9.8.0.0(2),.0,.0(1)(3),(1)]nonadec-13(18)-ene-3,17-dione
1alpha-methoxy-15-(2-methylbutyryloxy)-9-oxo-germacra-4-trans,10(14),11(13)-trien-12,6alpha-olide
(11beta,17alphaOH)-11,17,21-Trihydroxy-3,20-dioxopregn-4-en-18-al
Nemosenin D = (1beta,10beta-Epoxy-3beta-acetoxy-6beta-isobutyryloxy-furoeremophilan)
rel-(7R,8S,1R,3R,4R,5R,6R)-Delta8-4,5-epoxy-6-hydroxy-3,4,3-trimethoxy-8.1,7.O.6-neolignan
(7S,8R,1S,2S,3R)-Delta8-2,4-dihydroxy-3,35-trimethoxy-1,2,3,4-tetrahydro-4-oxo-7.3,8.1-neolignan
16(S)-methoxymethyl-6beta,7beta-dihydroxy-7alpha,20-epoxy-ent-kaur-2,3-ethenylene-1,15-dione|Epi-maoecrystal P
1beta,10beta-epoxy-8beta-ethoxy-6beta-[(2-methylacryloyl)oxy]eremophil-7(11)-12,8alpha-olide|rel-(1aR,4S,4aS,5S,8aS,9aS)-8a-ethoxy-2,3,4,4a,5,7,8a,9-octahydro-4,4a,6-trimethyl-7-oxo-1aH-oxireno[8,8a]naphtho[2,3-b]furan-5-yl 2-methylprop-2-enoate
1beta,10beta-epoxy-6beta-angeloyloxy-8beta-methoxyeremophil-7(11)-en-8alpha,12-olide
3beta-hydroxy-6beta-angeloyloxy-8alpha-methoxyeremophil-1(10),7(11)-dien-12,8beta-olide
1alpha-methoxy-15-isovaleryloxy-9-oxo-germacra-4-trans,10(14),11(13)-trien-12,6alpha-olide
(2R,2S,3R,4bS,7R,8aR,9S)-7-Formyloxy-4b,5,6,7,8,8a,9,10-octahydro-3,9-dihydroxy-2,4b,8,8-tetramethylspiro(cyclopropan-1,2(1H)-phenanthren)-1,4(3H)-dion|(2R,2S,3R,4bS,7R,8aR,9S)-7-Formyloxy-4b,5,6,7,8,8a,9,10-octahydro-3,9-dihydroxy-2,4b,8,8-tetramethylspiro-1,4(3H)-dion
(1alpha,6beta,20R)-1,7:6,20-diepoxy-6-hydroxy-20-methoxy-6,7-seco-ent-kaur-16-ene-7,15-dione|serrin C
(-)-secoisolariciresinol 4-O-methyl ether|(2R,3R)-2-(4-hydroxy-3-methoxybenzyl)-3-(3,4-dimethoxybenzyl)-1,4-butanediol|(2R,3R)-2-(4-hydroxy-3-methoxybenzyl)-3-(3,4-dimethoxybenzyl)-1,4-butanediol|(8R,8R)-3,3,4-trimethoxylignan-4,9,9-triol|Secoisolariciresinol-monomethylether
3beta-angeloyloxy-10beta-hydroxy-6beta-methoxyeremophila-7(11),8(9)-dien-8,12-olide|3??-Angeloyloxy-10??-hydroxy-6??-methoxyeremophila-7(11),8(9)-dien-8,12-olide
(1R,2S,3R,4aR,5R,8aR)-5-[2-(furan-3-yl)-2-oxoethyl]decahydro-3-hydroxy-1-(hydroxymethyl)-4a-methyl-6-methylidenenaphthalen-2-yl acetate|inulifolinone E
2beta-methoxy-6alpha-O-angeloyl-2,3-dihydrohelenalin
(E)-3,5-dimethoxy-4-(S-2-methylbutyryloxy)phenylpropenyl angelate
(4S,5R,6R,8R,9R,10S,12S,18S)-15,16-epoxy-19-hydroxyneocleroda-13(16),14-dien-20,12-olide-6,18-methylacetal|teupolin XI
erythro-2,3-bis(4-hydroxy-3-methoxyphenyl)-3-butoxypropan-1-ol
19,20-epoxy-12-methoxy-11,14,19-trihydroxy-7-oxo-8,11,13-abietatriene
(E)-3,5-dimethoxy-4-isopentanoyloxyphenylpropenyl angelate
inulifolinone F|[(1R,2S,3R,4aR,5R,8aR)-5-[2-(furan-3-yl)-2-oxoethyl]decahydro-2,3-dihydroxy-4a-methyl-6-methylidenenaphthalen-1-yl]methyl acetate
6beta,12,15-triacetoxy-1beta,7alpha,10betaH-guaia-4,11(13)-dien-3-one
7alpha-hydroxypodocarpen-8(14)-en-13-on-18-O-butanedioic acid|abiesanordine H
3beta-angeloyloxy-8alpha-hydroxy-6beta-methoxyeremophil-7(11),9(10)-dien-8,12-olide
(4S,6R,7S,8S,10R,11S,16R)-1-oxo-3(10),8(16)-diepoxy-16-methylprop-1Z-enyl-16-methoxygermacra-2-en-6(12)-olide
Me ester-3,4-Seco-4(18),13-halimadiene-16,15:20,5-diolid-3-oic acid
(2R,3S,4R,4aR,8R,8aR)-8-[2-(furan-3-yl)-2-oxoethyl]decahydro-3-hydroxy-4-(hydroxymethyl)-8a-methyl-7-methylidenenaphthalen-2-yl acetate|inulifolinone D
11,14,15-trihydroxy-12-methoxy-20-oxo-8,11,13-abietatrien-7-one
1alpha-acetoxy-6beta-isobutyryloxy-10alphaH-9-oxofuranoeremophilane
(1alpha,6beta,20R/20S)-1,7:6,20-diepoxy-20-hydroxy-6-methoxy-6,7-seco-ent-kaur-16-ene-7,15-dione|isodocarpin|serrin B
3alpha,4alpha-epoxy-6alpha-(2-methylacryloyl)oxy-8alpha-ethoxyeremophil-7(11)-en-8beta,12-olide
6beta,8alpha-dihydroxy-3beta-<4-methylsenecioyloxy>-eremophila-1(10),7(11)-dien-12,8beta-olide
ent-7beta,14-dihydroxy-11alpha-methoxy-18-oxo-11beta,20-epoxy-kaur-16-en-15-one|macrocalyxin B
2,3-epoxy-2-(2-tigloyloxy-4-methyl-5-methoxyphenyl)propyl isovalerate
C21H28O6_2H,11H-Naphtho[2,1-b]pyrano[3,2-e]pyran-9-carboxylic acid, 1,3,4,4a,5,6,6a,12,12a,12b-decahydro-3-hydroxy-4,4,6a,12b-tetramethyl-11-oxo
C21H28O6_2-Butenoic acid, 2-methyl-, (2Z)-2-[[1-(3,4-dimethoxyphenyl)propoxy]carbonyl]-2-buten-1-yl ester, (2E)
C21H28O6_(10E)-6-Formyl-5-methoxy-10-methyl-3-methylene-2-oxo-2,3,3a,4,5,8,9,11a-octahydrocyclodeca[b]furan-4-yl 2-methylbutanoate
8-hydroxy-2,7,7,11,15-pentamethyl-5,12,16-trioxapentacyclo[9.8.0.0²,⁸.0⁴,⁶.0¹³,¹⁸]nonadec-13(18)-ene-3,17-dione
8-hydroxy-2,7,7,11,15-pentamethyl-5,12,16-trioxapentacyclo[9.8.0.0²,?.0?,?.0¹³,¹?]nonadec-13(18)-ene-3,17-dione
18-Oxocortisol
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones A steroid aldehyde that is cortisol carrying a formyl group at position 18.
14-Hydroxy-7-O-methylrosmanol
12a-Hydroxy-13,18-dehyroparain
Antibiotic FR 901512
ST 21:4;O6
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
Norcaesalpinin E
A diterpenoid isolated from the seed kernels of Caesalpinia crista that has been found to exhibit antimalarial activity.
16α-hydroxyprednisolone
16α-hydroxyprednisolone is a metabolite of budesonide. Budesonide is a glucocorticoid steroid for the treatment of asthma and non-infectious rhinitis (including hay fever and other allergies), and for treatment and prevention of nasal polyposis. In addition, it is used for Crohns disease. (Wikipedia)
5-Hydroxy-2,6,6,10-tetramethyl-16-oxo-11,13-dioxatetracyclo[8.8.0.02,7.012,17]octadeca-12(17),14-diene-14-carboxylic acid
1-(3,4-dimethoxyphenyl)propyl (Z)-2-[[(E)-2-methylbut-2-enoyl]oxymethyl]but-2-enoate
6beta-Hydroxyprednisolone
A glucocorticoid that is prednisolone carrying a hydroxy group at the 6beta position. It is a metabolite of prednisolone found in human urine.
azanigerone B
An azaphilone that is the ester obtained by formal condensation of the carboxy group of 2,4-dimethylhexanoic acid with the tertiary hydroxy group of 7-hydroxy-3-(2-hydroxypropyl)-7-methyl-6H-2-benzopyran-6,8(7H)-dione.
(8S,9S,10R,11S,13S,14S,17S)-11,16,17-trihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-3-one
[(6Z,10E)-6-formyl-5-methoxy-10-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] 2-methylbutanoate
6alpha-Hydroxyprednisolone
A glucocorticoid that is prednisolone carrying a hydroxy group at the 6alpha position. It is a metabolite of prednisolone found in human urine.
(3s,5s)-3,5-Dihydroxy-1,7-bis(4-hydroxy-3-methoxyphenyl)heptane
[(10Z)-6-formyl-5-methoxy-10-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] 2-methylbutanoate
6beta-hydroxycortisone
A C21-steroid that is cortisone bearing an additional hydroxy substituent at the 6beta-position. It is produced as a metabolite of cortisol by cytochrome p450-3A4 (CYP3A4, an important enzyme involved in the metabolism of a variety of exogenous and endogenous compounds) and can be used to detect moderate and potent CYP3A4 inhibition in vivo.
16alpha-Hydroxyprednisolone
A 16-hydroxyprednisolone in which the hydroxy group at position 16 adopts alpha-configuration. It is a metabolite of budesonide found in human urine and plasma.
3-[5,8-dihydroxy-6-isopropyl-7-methoxy-1-methyl-4-oxo-2-(prop-1-en-2-yl)-2,3-dihydronaphthalen-1-yl]propanoic acid
(1s,4s,8r,9r,11s,12r,13s,16r)-11-hydroxy-9-methoxy-7,7-dimethyl-17-methylidene-3,10-dioxapentacyclo[14.2.1.0¹,¹³.0⁴,¹².0⁸,¹²]nonadecane-2,18-dione
(4s,4ar,5s,8s,8as)-8-(acetyloxy)-3,4a,5-trimethyl-9-oxo-4h,5h,6h,7h,8h,8ah-naphtho[2,3-b]furan-4-yl 2-methylpropanoate
(1's,3r,3ar,4r,6's,7'r,7ar,9's)-7'-hydroxy-3-methoxy-7a-methyl-10'-methylidene-hexahydro-3'-oxaspiro[2-benzofuran-4,5'-tricyclo[7.2.1.0¹,⁶]dodecane]-2',11'-dione
(3r,5s)-1-(4-hydroxy-3,5-dimethoxyphenyl)-7-(4-hydroxyphenyl)heptane-3,5-diol
4-(2,5-dihydroxyphenyl)-2-{2-[(1r,3s)-3-hydroxy-2,2-dimethyl-6-methylidenecyclohexyl]ethyl}-4-oxobutanoic acid
(3as,5r,5's,6's,6as)-3,3,6a-trimethyl-6'-(2-methylpropanoyl)-5'-(prop-1-en-2-yl)-dihydrospiro[cyclopenta[c]furan-5,3'-oxane]-1,2',6-trione
5-(acetyloxy)-4a,8-dimethyl-3-methylidene-2-oxo-3ah,4h,5h,6h,7h,9h,9ah-azuleno[6,5-b]furan-4-yl 2-methylpropanoate
3,9-dihydroxy-2-(2-hydroxypropyl)-10-methoxy-4b,7-dimethyl-8-methylidene-5,6,7,8a,9,10-hexahydrophenanthrene-1,4-dione
methyl (2e)-5-(furan-3-yl)-2-{3-[(3e,6r)-6-(2-hydroxypropan-2-yl)-2-oxooxan-3-ylidene]propyl}pent-2-enoate
(1r,2s,3r,4ar,5r,8ar)-5-[2-(furan-3-yl)-2-oxoethyl]-3-hydroxy-1-(hydroxymethyl)-4a-methyl-6-methylidene-octahydronaphthalen-2-yl acetate
(1r,2r,3s,6r,7s)-7-(2h-1,3-benzodioxol-5-yl)-1,3-dimethoxy-6-methyl-5-(prop-2-en-1-yl)bicyclo[3.2.1]octane-2,8-diol
methyl 8a-[5-(furan-3-yl)-2-oxooxolan-3-yl]-2,4a-dimethyl-hexahydro-2h-1-benzopyran-5-carboxylate
9,10-dihydroxy-6-(methoxymethyl)-12,12-dimethyl-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadec-13-ene-7,15-dione
(4r,11as)-6,10-dimethyl-3-methylidene-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-4-yl (2e)-4-hydroxy-2-(methoxymethyl)but-2-enoate
(4s,11s)-2-hydroxy-5,5-dimethyl-17-methylidene-10,16-dioxo-15-oxatetracyclo[11.2.2.0¹,¹⁴.0⁴,⁹]heptadecan-11-yl acetate
5-[2-(furan-3-yl)-2-oxoethyl]-3-hydroxy-1-(hydroxymethyl)-4a-methyl-6-methylidene-octahydronaphthalen-2-yl acetate
{7-methoxy-3,6-dimethylidene-2,5-dioxo-3ah,4h,7h,8h,9h,11ah-cyclodeca[b]furan-10-yl}methyl 2-methylbutanoate
4-hydroxy-15-methoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadec-14-ene-3,11,16-trione
(1's,3s,3ar,4r,6's,7'r,7ar,9's)-7'-hydroxy-3-methoxy-7a-methyl-10'-methylidene-hexahydro-3'-oxaspiro[2-benzofuran-4,5'-tricyclo[7.2.1.0¹,⁶]dodecane]-2',11'-dione
10-[5-(acetyloxy)-4-methyl-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-1-yl]-4,8-dimethyldeca-4,8-dienoic acid
(1s,2s,5r,6r,8s,9s,10s,11r)-9,10-dihydroxy-6-(methoxymethyl)-12,12-dimethyl-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadec-13-ene-7,15-dione
(1'r,3r,3as,4s,6'r,7's,7as,9'r)-7'-hydroxy-3-methoxy-7a-methyl-10'-methylidene-hexahydro-3'-oxaspiro[2-benzofuran-4,5'-tricyclo[7.2.1.0¹,⁶]dodecane]-2',11'-dione
(4r,5r,7r,8r,13s,16s,19r,22r)-7,8-dihydroxy-5,19-dimethyl-15,18,20-trioxapentacyclo[14.5.1.0⁴,¹³.0⁵,¹⁰.0¹⁹,²²]docosa-1(21),10-dien-14-one
(3ar,4r,11ar)-6,10-dimethyl-3-methylidene-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-4-yl (3r)-4-hydroxy-3-methoxy-2-methylidenebutanoate
3-ethoxy-6,9,10-trimethyl-5-oxo-4,14-dioxatetracyclo[7.5.0.0¹,¹³.0³,⁷]tetradec-6-en-8-yl 2-methylprop-2-enoate
12-o-methylcandesalvone b
{"Ingredient_id": "HBIN000947","Ingredient_name": "12-o-methylcandesalvone b","Alias": "NA","Ingredient_formula": "C21H28O6","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14203","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
6-epiangustifolin
{"Ingredient_id": "HBIN012331","Ingredient_name": "6-epiangustifolin","Alias": "NA","Ingredient_formula": "C21H28O6","Ingredient_Smile": "CC12CCCC3(C1C(OC2)OC)COC(=O)C45C3C(CC(C4)C(=C)C5=O)O","Ingredient_weight": "376.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6825","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101223772","DrugBank_id": "NA"}
angustifolin
{"Ingredient_id": "HBIN016135","Ingredient_name": "angustifolin","Alias": "NA","Ingredient_formula": "C21H28O6","Ingredient_Smile": "CC12CCCC3(C1C(OC2)OC)COC(=O)C45C3C(CC(C4)C(=C)C5=O)O","Ingredient_weight": "376.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1245","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "21575185","DrugBank_id": "NA"}