Exact Mass: 462.4072734
Exact Mass Matches: 462.4072734
Found 203 metabolites which its exact mass value is equals to given mass value 462.4072734,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
(3beta,22R,23R,24S)-3,22,23-Trihydroxystigmastan-6-one
(3alpha,22R,23R,24S)-3,22,23-Trihydroxystigmastan-6-one is found in cereals and cereal products. (3alpha,22R,23R,24S)-3,22,23-Trihydroxystigmastan-6-one is a constituent of ricebran (Oryza sativa).
6-Deoxohomodolichosterone
Constituent of Phaseolus vulgaris (kidney bean) seed. 6-Deoxohomodolichosterone is found in pulses, yellow wax bean, and green bean. 6-Deoxohomodolichosterone is found in pulses. 6-Deoxohomodolichosterone is a constituent of Phaseolus vulgaris (kidney bean) seed
(Z)-22-Hentriacontene-2,4-dione
(Z)-22-Hentriacontene-2,4-dione is found in herbs and spices. (Z)-22-Hentriacontene-2,4-dione is a constituent of the epicuticular waxes of Vanilla fragrans (vanilla) and Vanilla tahitensis (Tahitian vanilla) Constituent of the epicuticular waxes of Vanilla fragrans (vanilla) and Vanilla tahitensis (Tahitian vanilla). (Z)-22-Hentriacontene-2,4-dione is found in herbs and spices.
2alpha-(3-Hydroxypropyl)-1alpha,25-dihydroxy-19-norvitamin D3
2-Deoxy-28-homocastasterone
2-deoxy-28-homocastasterone belongs to stigmastanes and derivatives class of compounds. Those are sterol lipids with a structure based on the stigmastane skeleton, which consists of a cholestane moiety bearing an ethyl group at the carbon atom C24. 2-deoxy-28-homocastasterone is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 2-deoxy-28-homocastasterone can be found in common bean, green bean, and yellow wax bean, which makes 2-deoxy-28-homocastasterone a potential biomarker for the consumption of these food products.
6-Deoxo-28-homo-dolichosterone
6-deoxo-28-homo-dolichosterone belongs to stigmastanes and derivatives class of compounds. Those are sterol lipids with a structure based on the stigmastane skeleton, which consists of a cholestane moiety bearing an ethyl group at the carbon atom C24. 6-deoxo-28-homo-dolichosterone is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 6-deoxo-28-homo-dolichosterone can be found in common bean, green bean, and yellow wax bean, which makes 6-deoxo-28-homo-dolichosterone a potential biomarker for the consumption of these food products.
6-Deoxo-25-methyldolichosterone
6-deoxo-25-methyldolichosterone belongs to tetrahydroxy bile acids, alcohols and derivatives class of compounds. Those are prenol lipids structurally characterized by a bile acid or alcohol which bears four hydroxyl groups. 6-deoxo-25-methyldolichosterone is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 6-deoxo-25-methyldolichosterone can be found in common bean, green bean, and yellow wax bean, which makes 6-deoxo-25-methyldolichosterone a potential biomarker for the consumption of these food products.
23,24-dimethylcholest-16(17)-E-ene-3beta,5alpha,6beta,20(S)-tetraol
(20S)-5-stigmastene-3beta,7alpha,16beta,20-tetrol
A natural product found in Melia toosendan.
(5S)-3a-acetyl-2,3,5-trimethyl-7a-hydroxy-5-(4,8,12-trimethyltridecyl)-1,3a,5,6,7,7a-hexahydrocyclopenta[b]pyran-1-one
(E)-(24R,25R)-23,24-dimethyl-5alpha-cholest-22-ene-3beta,6alpha,15beta,26-tetrol|certonardosterol J
20(S)-hydroxydammar-3beta,25-diol|3beta,20(S),25-trihydroxydammarane|dammara-3beta,20(S),25-triol
(24S)-24-ethyl-5alpha-cholest-8(14)-ene-3beta,5,6beta,7alpha-tetrol
rel-(2R,4aR,8aR)-3,4,4a,8a-tetrahydro-4a-hydroxy-2,6,7,8a-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-chromene-5,8-dione
(+)-7-hydroxyxestospongin A|(+)-7-OH-Xestospongin A
(2beta,3beta,4alpha,5alpha,8beta,11beta)-4-methylergost-24(28)-ene-2,3,8,11-tetrol
(24S)-23,24-dimethylcholesta-22-en-3beta,5alpha,6beta,11alpha-tetraol
(23R,24R)-23,24-dimethylcholesta-17(20)-en-3beta,5alpha,6beta-triol
5alpha-methoxy-24-methylenecholestan-3beta,6beta,19-triol|nebrosteroid P
n-tridecanyl n-octadec-9, 12-dienoate|n-tridecanyl n-octadec-9,12-dienoate
17,24-epoxy-25-hydroxy-21-methoxy-3,4-secobaccharane
(24S)-24-ethyl-5alpha-cholest-8-ene-3beta,5,6beta,7alpha-tetrol
2H-protopanaxadiol|Dihydroprotopanaxadiol; (12beta-Hydroxy-dammarandiol I)
7alpha-Hydroperoxy-stigmasten-(5)-diol-(3alpha,22alpha)
2α-(3-Hydroxypropyl)-1α,25-dihydroxy-19-norvitamin D3
6-Deoxohomodolichosterone
28-Homoteasterone
2alpha-(3-Hydroxypropyl)-1alpha,25-dihydroxy-19-norvitamin D3
2-[2-[2-[2-(2-hexadecoxyethoxy)ethoxy]ethoxy]ethoxy]ethanol
(1,1-Dimethylpiperidin-1-ium-4-yl) octadecyl hydrogen phosphate
C25H53NO4P+ (462.37120080000005)
5-[(2E)-2-[1-(6-hydroxy-6-methylheptan-2-yl)-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-2-(3-hydroxypropyl)cyclohexane-1,3-diol
23,24-dimethylcholest-16(17)-E-en-3beta,5alpha,6beta,20(S)-tetrol
A 3beta-hydroxy steroid consisting of 23,24-dimethylcholest-16-ene substituted by hydroxy groups at positions 3, 5, 6 and 20 (the 3beta,5alpha,6beta,20S stereoisomer). Isolated from the soft coral Sarcophyton trocheliophorum, it exhibits cytotoxic activity against human cancer cells.
[1-hydroxy-3-[(12Z,15Z,18Z,21Z)-tetracosa-12,15,18,21-tetraenoxy]propan-2-yl] acetate
[1-[(10Z,13Z,16Z,19Z)-docosa-10,13,16,19-tetraenoxy]-3-hydroxypropan-2-yl] butanoate
[1-hydroxy-3-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoxy]propan-2-yl] octanoate
[1-hydroxy-3-[(8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoxy]propan-2-yl] hexanoate
(1-hydroxy-3-octoxypropan-2-yl) (6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoate
[1-[(4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoxy]-3-hydroxypropan-2-yl] decanoate
(1-decoxy-3-hydroxypropan-2-yl) (4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoate
[3-carboxy-2-[(9E,11E,13E,15E)-henicosa-9,11,13,15-tetraenoyl]oxypropyl]-trimethylazanium
2,3-dihydroxypropyl (14Z,17Z,20Z,23Z)-hexacosa-14,17,20,23-tetraenoate
(3beta,22R,23R,24S)-3,22,23-Trihydroxystigmastan-6-one
DG(26:4)
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2-{7-hydroxy-3a,3b,6,6,9a-pentamethyl-dodecahydro-1h-cyclopenta[a]phenanthren-1-yl}-6-methylheptane-2,6-diol
1-[1-(dimethylamino)ethyl]-2',9a,11a-trimethyl-1,2,3,3a,3b,4,5,5a,6,8,9,9b,10,11-tetradecahydrospiro[cyclopenta[a]phenanthrene-7,1'-isoindol]-3'-one
C31H46N2O (462.36099459999997)
3-docosyl-2-hydroxy-5-methoxycyclohexa-2,5-diene-1,4-dione
9-acetyl-9-hydroxy-2,7,8-trimethyl-2-(4,8,12-trimethyltridecyl)-1-oxaspiro[4.4]non-7-en-6-one
1-(2-hydroxy-6-methylheptan-2-yl)-3a,3b,6,6,9a-pentamethyl-dodecahydro-1h-cyclopenta[a]phenanthrene-7,11-diol
(3s,4r,6s)-6-[(1s,3ar,3br,5ar,7s,9ar,9bs,11as)-7-hydroxy-3a,6,6,9a,11a-pentamethyl-dodecahydro-1h-cyclopenta[a]phenanthren-1-yl]-2-methylheptane-3,4-diol
(1r,3ar,3br,5r,5as,7s,9ar,9bs,11ar)-3a,7-dihydroxy-9a,11a-dimethyl-1-[(2r)-6-methylheptan-2-yl]-tetradecahydrocyclopenta[a]phenanthren-5-yl acetate
(1s,3as,3br,5ar,7s,9as,9br,11as)-1-[(1s)-1-(dimethylamino)ethyl]-2',9a,11a-trimethyl-1,2,3,3a,3b,4,5,5a,6,8,9,9b,10,11-tetradecahydrospiro[cyclopenta[a]phenanthrene-7,1'-isoindol]-3'-one
C31H46N2O (462.36099459999997)
2-{8-isopropyl-12a-methoxy-7,10a,10b-trimethyl-7-propyl-dodecahydro-1h-phenanthro[1,2-b]pyran-3-yl}propan-2-ol
28-homotyphasterol
{"Ingredient_id": "HBIN005058","Ingredient_name": "28-homotyphasterol","Alias": "NA","Ingredient_formula": "C29H50O4","Ingredient_Smile": "CCC(C(C)C)C(C(C(C)C1CCC2C1(CCC3C2CC(=O)C4C3(CCC(C4)O)C)C)O)O","Ingredient_weight": "462.7 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8728","PubChem_id": "12017268","DrugBank_id": "NA"}
(?)-α-tocospirone
{"Ingredient_id": "HBIN015729","Ingredient_name": "(?)-\u03b1-tocospirone","Alias": "NA","Ingredient_formula": "C29H50O4","Ingredient_Smile": "CC1=C(C(=O)C2(CCC(O2)(C)CCCC(C)CCCC(C)CCCC(C)C)C(C1=O)(C)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21400","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2-methylpropyl 2-hydroxy-19-(4-hydroxyphenyl)nonadecanoate
(1r,3as,3bs,5as,7r,9ar,9bs,11as)-1-[(2s,3r,4r,5s)-5-ethyl-3,4-dihydroxy-6-methylheptan-2-yl]-7-hydroxy-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthren-5-one
9,30-dioxa-11,25-diazapentacyclo[20.6.2.2⁸,¹¹.0¹⁰,¹⁵.0²⁵,²⁹]dotriacontan-1-ol
(2s,5r,9s)-9-acetyl-9-hydroxy-2,7,8-trimethyl-2-[(4r,8r)-4,8,12-trimethyltridecyl]-1-oxaspiro[4.4]non-7-en-6-one
1-(2-hydroxy-4,5,6-trimethylheptan-2-yl)-9a,11a-dimethyl-3h,3ah,3bh,4h,5h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthrene-5,5a,7-triol
(1s,3ar,3br,5ar,7s,9ar,9br,11r,11ar)-1-[(2r)-2-hydroxy-6-methylheptan-2-yl]-3a,3b,6,6,9a-pentamethyl-dodecahydro-1h-cyclopenta[a]phenanthrene-7,11-diol
(2r,5r,9s)-9-acetyl-9-hydroxy-2,7,8-trimethyl-2-[(4r,8r)-4,8,12-trimethyltridecyl]-1-oxaspiro[4.4]non-7-en-6-one
(1s,3as,3br,5ar,7r,9as,9bs,11as)-1-[(1s)-1-(dimethylamino)ethyl]-2',9a,11a-trimethyl-1,2,3,3a,3b,4,5,5a,6,8,9,9b,10,11-tetradecahydrospiro[cyclopenta[a]phenanthrene-7,1'-isoindol]-3'-one
C31H46N2O (462.36099459999997)
(1s,3as,3br,5as,7r,9as,9bs,11ar)-1-[(1s)-1-(dimethylamino)ethyl]-2',9a,11a-trimethyl-1,2,3,3a,3b,4,5,5a,6,8,9,9b,10,11-tetradecahydrospiro[cyclopenta[a]phenanthrene-7,1'-isoindol]-3'-one
C31H46N2O (462.36099459999997)
(1s,7r,9as,11as)-1-[(1s)-1-(dimethylamino)ethyl]-2',9a,11a-trimethyl-1,2,3,3a,3b,4,5,5a,6,8,9,9b,10,11-tetradecahydrospiro[cyclopenta[a]phenanthrene-7,1'-isoindol]-3'-one
C31H46N2O (462.36099459999997)
(2r,5r,10r)-10-hydroxy-2,7,8,10-tetramethyl-2-[(4r,8r)-4,8,12-trimethyltridecyl]-1-oxaspiro[4.5]dec-7-ene-6,9-dione
(1r,8r,10s,15r,22r,29s)-9,30-dioxa-11,25-diazapentacyclo[20.6.2.2⁸,¹¹.0¹⁰,¹⁵.0²⁵,²⁹]dotriacontan-1-ol
(1s,8s,10r,15r,22s,29r)-9,30-dioxa-11,25-diazapentacyclo[20.6.2.2⁸,¹¹.0¹⁰,¹⁵.0²⁵,²⁹]dotriacontan-1-ol
6-{7-hydroxy-3a,6,6,9a,11a-pentamethyl-dodecahydro-1h-cyclopenta[a]phenanthren-1-yl}-2-methylheptane-3,4-diol
2-[(3s,4ar,4bs,6ar,7s,8r,10ar,10br,12as)-8-isopropyl-12a-methoxy-7,10a,10b-trimethyl-7-propyl-dodecahydro-1h-phenanthro[1,2-b]pyran-3-yl]propan-2-ol
(2s)-2-[(1s,3ar,3br,5ar,7s,9ar,9br,11ar)-7-hydroxy-3a,3b,6,6,9a-pentamethyl-dodecahydro-1h-cyclopenta[a]phenanthren-1-yl]-6-methylheptane-2,6-diol
3a,7-dihydroxy-9a,11a-dimethyl-1-(6-methylheptan-2-yl)-tetradecahydrocyclopenta[a]phenanthren-5-yl acetate
(1s,3as,3br,5as,7r,9as,9bs,11as)-1-[(1s)-1-(dimethylamino)ethyl]-2',9a,11a-trimethyl-1,2,3,3a,3b,4,5,5a,6,8,9,9b,10,11-tetradecahydrospiro[cyclopenta[a]phenanthrene-7,1'-isoindol]-3'-one
C31H46N2O (462.36099459999997)
(4e,6z,14s,19z,21z,29s,30r)-1,16-diazatetracyclo[27.3.1.1¹²,¹⁶.0¹⁴,³⁰]tetratriaconta-4,6,12,19,21-pentaene
(1s,7r,9as,11as)-1-[1-(dimethylamino)ethyl]-2',9a,11a-trimethyl-1,2,3,3a,3b,4,5,5a,6,8,9,9b,10,11-tetradecahydrospiro[cyclopenta[a]phenanthrene-7,1'-isoindol]-3'-one
C31H46N2O (462.36099459999997)
(1s,3as,3bs,5as,7r,9as,9br,11as)-1-[(1s)-1-(dimethylamino)ethyl]-2',9a,11a-trimethyl-1,2,3,3a,3b,4,5,5a,6,8,9,9b,10,11-tetradecahydrospiro[cyclopenta[a]phenanthrene-7,1'-isoindol]-3'-one
C31H46N2O (462.36099459999997)
1-(5-ethyl-6-methylheptan-2-yl)-9a,11a-dimethyl-1h,2h,3h,4h,5h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthrene-4,5,5a,7-tetrol
(1r,3r,3as,3br,5s,5as,7s,9ar,9bs,11ar)-1-[(2r,3e,5r,6r)-7-hydroxy-4,5,6-trimethylhept-3-en-2-yl]-9a,11a-dimethyl-tetradecahydro-1h-cyclopenta[a]phenanthrene-3,5,7-triol
(4z,6z,14s,19z,21z,29s,30s)-1,16-diazatetracyclo[27.3.1.1¹²,¹⁶.0¹⁴,³⁰]tetratriaconta-4,6,12,19,21-pentaene
4-carbamimidamidobutyl (1s,4s,5r,6r,10r)-6-methyl-10-nonyl-7,9,12-triazatricyclo[6.3.1.0⁴,¹²]dodec-7-ene-5-carboxylate
C25H46N6O2 (462.36820559999995)
(1s,9as,11as)-1-[1-(dimethylamino)ethyl]-2',9a,11a-trimethyl-1,2,3,3a,3b,4,5,5a,6,8,9,9b,10,11-tetradecahydrospiro[cyclopenta[a]phenanthrene-7,1'-isoindol]-3'-one
C31H46N2O (462.36099459999997)
(2r,4as,7ar)-7a-acetyl-4a-hydroxy-2,6,7-trimethyl-2-[(4r,8r)-4,8,12-trimethyltridecyl]-3h,4h-cyclopenta[b]pyran-5-one
1-(5-ethyl-6-methylheptan-2-yl)-9a,11a-dimethyl-1h,2h,3h,3ah,4h,5h,6h,7h,8h,9h,10h,11h-cyclopenta[a]phenanthrene-4,5,5a,7-tetrol
1-(7-hydroxy-4,5,6-trimethylhept-3-en-2-yl)-9a,11a-dimethyl-tetradecahydro-1h-cyclopenta[a]phenanthrene-3,5,7-triol
(1r,3ar,4s,5r,5ar,7s,9ar,11ar)-1-[(2r,5s)-5-ethyl-6-methylheptan-2-yl]-9a,11a-dimethyl-1h,2h,3h,3ah,4h,5h,6h,7h,8h,9h,10h,11h-cyclopenta[a]phenanthrene-4,5,5a,7-tetrol
(1s,3as,3br,5as,7s,9as,9bs,11as)-1-[(1s)-1-(dimethylamino)ethyl]-2',9a,11a-trimethyl-1,2,3,3a,3b,4,5,5a,6,8,9,9b,10,11-tetradecahydrospiro[cyclopenta[a]phenanthrene-7,1'-isoindol]-3'-one
C31H46N2O (462.36099459999997)
4a-hydroxy-2,6,7,8a-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-1-benzopyran-5,8-dione
(1s,3ar,3br,5as,7s,8r,9ar,9br,11as)-1-[(2s,3r,4r,5e)-3,4-dihydroxy-5-isopropylhept-5-en-2-yl]-9a,11a-dimethyl-tetradecahydro-1h-cyclopenta[a]phenanthrene-7,8-diol
(3as,3bs,5r,5ar,7s,9ar,9bs,11as)-1-[(2r,4r,5r)-2-hydroxy-4,5,6-trimethylheptan-2-yl]-9a,11a-dimethyl-3h,3ah,3bh,4h,5h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthrene-5,5a,7-triol
(1r,2s,3as,3bs,4s,7s,9ar,9bs,11as)-1-[(2s,5r)-5-ethyl-2-hydroxy-6-methylheptan-2-yl]-9a,11a-dimethyl-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthrene-2,4,7-triol
7a-acetyl-4a-hydroxy-2,6,7-trimethyl-2-(4,8,12-trimethyltridecyl)-3h,4h-cyclopenta[b]pyran-5-one
(1s,3as,3br,5as,7s,9as,9br,11as)-1-[(1s)-1-(dimethylamino)ethyl]-2',9a,11a-trimethyl-1,2,3,3a,3b,4,5,5a,6,8,9,9b,10,11-tetradecahydrospiro[cyclopenta[a]phenanthrene-7,1'-isoindol]-3'-one
C31H46N2O (462.36099459999997)
4-carbamimidamidobutyl (6r,10s)-6-methyl-10-nonyl-7,9,12-triazatricyclo[6.3.1.0⁴,¹²]dodec-7-ene-5-carboxylate
C25H46N6O2 (462.36820559999995)