Details
Stereochemistry | MIXED |
Molecular Formula | C21H30O6 |
Molecular Weight | 378.4593 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 7 / 9 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@@]1(O)C[C@@]2([H])[C@]3([H])CCC4CC(O)C=C[C@]4(C)[C@@]3([H])C(=O)C[C@]2(C)[C@@]1(O)C(=O)CO
InChI
InChIKey=KCCKOAMJUDFXOF-OSPVKULHSA-N
InChI=1S/C21H30O6/c1-19-6-5-12(23)7-11(19)3-4-13-14-8-16(25)21(27,17(26)10-22)20(14,2)9-15(24)18(13)19/h5-6,11-14,16,18,22-23,25,27H,3-4,7-10H2,1-2H3/t11?,12?,13-,14-,16+,18+,19-,20-,21-/m0/s1
Molecular Formula | C21H30O6 |
Molecular Weight | 378.4593 |
Charge | 0 |
Count |
|
Stereochemistry | MIXED |
Additional Stereochemistry | No |
Defined Stereocenters | 7 / 9 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 10:49:51 UTC 2023
by
admin
on
Sat Dec 16 10:49:51 UTC 2023
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Record UNII |
XVV1YX4V1J
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Record Status |
Validated (UNII)
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Record Version |
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-
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Systematic Name | English |
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1379578-69-4
Created by
admin on Sat Dec 16 10:49:51 UTC 2023 , Edited by admin on Sat Dec 16 10:49:51 UTC 2023
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XVV1YX4V1J
Created by
admin on Sat Dec 16 10:49:51 UTC 2023 , Edited by admin on Sat Dec 16 10:49:51 UTC 2023
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91810682
Created by
admin on Sat Dec 16 10:49:51 UTC 2023 , Edited by admin on Sat Dec 16 10:49:51 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> METABOLITE |
Catalyzed by two enzymes, the 4-ene-5.BETA.-reductase and the 4-ene-5.ALPHA.-reductase. The second stage utilizes the enzymes 3.ALPHA.- and, to a much lesser extent, 3.BETA.-hydroxysteroid dehydrogenases
MINOR
URINE
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