Details
| Stereochemistry | UNKNOWN |
| Molecular Formula | C21H30O3 |
| Molecular Weight | 330.4611 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CCCC(O)CC1=CC(O)=C([C@@H]2C=C(C)CC[C@H]2C(C)=C)C(O)=C1
InChI
InChIKey=PVRJAZVKVQMBIZ-UQJFVLDMSA-N
InChI=1S/C21H30O3/c1-5-6-16(22)10-15-11-19(23)21(20(24)12-15)18-9-14(4)7-8-17(18)13(2)3/h9,11-12,16-18,22-24H,2,5-8,10H2,1,3-4H3/t16?,17-,18+/m0/s1
| Molecular Formula | C21H30O3 |
| Molecular Weight | 330.4611 |
| Charge | 0 |
| Count |
|
| Stereochemistry | EPIMERIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 3 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 14:44:21 UTC 2023
by
admin
on
Sat Dec 16 14:44:21 UTC 2023
|
| Record UNII |
7V535ST6LR
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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7V535ST6LR
Created by
admin on Sat Dec 16 14:44:21 UTC 2023 , Edited by admin on Sat Dec 16 14:44:21 UTC 2023
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53413-22-2
Created by
admin on Sat Dec 16 14:44:21 UTC 2023 , Edited by admin on Sat Dec 16 14:44:21 UTC 2023
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121596214
Created by
admin on Sat Dec 16 14:44:21 UTC 2023 , Edited by admin on Sat Dec 16 14:44:21 UTC 2023
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| Related Record | Type | Details | ||
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PARENT -> METABOLITE |
MINOR
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