Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C21H28O3 |
| Molecular Weight | 328.4452 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@@]12CC(=C)[C@](O)(C(C)=O)[C@@]1(C)CC[C@]3([H])[C@@]4([H])CCC(=O)C=C4CC[C@@]23[H]
InChI
InChIKey=SFLXYFZGKSGFKA-XUDSTZEESA-N
InChI=1S/C21H28O3/c1-12-10-19-18-6-4-14-11-15(23)5-7-16(14)17(18)8-9-20(19,3)21(12,24)13(2)22/h11,16-19,24H,1,4-10H2,2-3H3/t16-,17+,18+,19-,20-,21-/m0/s1
| Molecular Formula | C21H28O3 |
| Molecular Weight | 328.4452 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:38:53 UTC 2023
by
admin
on
Fri Dec 15 15:38:53 UTC 2023
|
| Record UNII |
09Q5UV3747
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C776
Created by
admin on Fri Dec 15 15:38:53 UTC 2023 , Edited by admin on Fri Dec 15 15:38:53 UTC 2023
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| Code System | Code | Type | Description | ||
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8221
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DTXSID00998190
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300000034674
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DB14584
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Segesterone
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DE-08
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CHEMBL2107778
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C66532
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Segesterone
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7690-08-6
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09Q5UV3747
Created by
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11823650
Created by
admin on Fri Dec 15 15:38:53 UTC 2023 , Edited by admin on Fri Dec 15 15:38:53 UTC 2023
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09Q5UV3747
Created by
admin on Fri Dec 15 15:38:53 UTC 2023 , Edited by admin on Fri Dec 15 15:38:53 UTC 2023
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2055978
Created by
admin on Fri Dec 15 15:38:53 UTC 2023 , Edited by admin on Fri Dec 15 15:38:53 UTC 2023
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