Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C27H31NO2 |
| Molecular Weight | 401.5405 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@H](C[C@]12C)C5=CC=C(N)C=C5
InChI
InChIKey=MIPBCIAEOBOEKD-YEEPMTPTSA-N
InChI=1S/C27H31NO2/c1-3-13-27(30)14-12-24-22-10-6-18-15-20(29)9-11-21(18)25(22)23(16-26(24,27)2)17-4-7-19(28)8-5-17/h4-5,7-8,15,22-24,30H,6,9-12,14,16,28H2,1-2H3/t22-,23+,24-,26-,27-/m0/s1
| Molecular Formula | C27H31NO2 |
| Molecular Weight | 401.5405 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 22:43:23 GMT 2025
by
admin
on
Mon Mar 31 22:43:23 GMT 2025
|
| Record UNII |
CN65R36QDD
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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Preferred Name | English | ||
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Code | English |
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104004-92-4
Created by
admin on Mon Mar 31 22:43:23 GMT 2025 , Edited by admin on Mon Mar 31 22:43:23 GMT 2025
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DTXSID00146215
Created by
admin on Mon Mar 31 22:43:23 GMT 2025 , Edited by admin on Mon Mar 31 22:43:23 GMT 2025
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16654965
Created by
admin on Mon Mar 31 22:43:23 GMT 2025 , Edited by admin on Mon Mar 31 22:43:23 GMT 2025
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CN65R36QDD
Created by
admin on Mon Mar 31 22:43:23 GMT 2025 , Edited by admin on Mon Mar 31 22:43:23 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE ACTIVE |
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