Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C21H30O6 |
Molecular Weight | 378.4593 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 9 / 9 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@@]1(O)C[C@@]2([H])[C@]3([H])CCC4=CC(=O)C=C[C@]4(C)[C@@]3([H])[C@@H](O)C[C@]2(C)[C@@]1(O)C(O)CO
InChI
InChIKey=NSAMWGIJBKAFLB-ATLUHFAJSA-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/h5-7,13-18,22,24-27H,3-4,8-10H2,1-2H3/t13-,14-,15-,16+,17-,18+,19-,20-,21-/m0/s1
Molecular Formula | C21H30O6 |
Molecular Weight | 378.4593 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 8 / 9 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 09:33:25 GMT 2023
by
admin
on
Sat Dec 16 09:33:25 GMT 2023
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Record UNII |
GT096KKW5T
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Record Status |
Validated (UNII)
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Record Version |
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-
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1379578-65-0
Created by
admin on Sat Dec 16 09:33:25 GMT 2023 , Edited by admin on Sat Dec 16 09:33:25 GMT 2023
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GT096KKW5T
Created by
admin on Sat Dec 16 09:33:25 GMT 2023 , Edited by admin on Sat Dec 16 09:33:25 GMT 2023
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91810678
Created by
admin on Sat Dec 16 09:33:25 GMT 2023 , Edited by admin on Sat Dec 16 09:33:25 GMT 2023
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Related Record | Type | Details | ||
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PARENT -> METABOLITE |
MINOR
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