Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C24H32O8 |
| Molecular Weight | 448.5061 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 11 / 11 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@@]12C[C@@]3(C)[C@@]([H])(CC[C@@]34CCC(=O)O4)[C@]5([H])[C@@H]([C@@H](O)C6=C[C@@H](O)[C@H](O)C[C@]6(C)[C@@]15O2)C(=O)OC
InChI
InChIKey=SFLNKZQOMSIFGF-YLTZHOJTSA-N
InChI=1S/C24H32O8/c1-21-10-15-24(31-15)18(11(21)4-6-23(21)7-5-16(27)32-23)17(20(29)30-3)19(28)12-8-13(25)14(26)9-22(12,24)2/h8,11,13-15,17-19,25-26,28H,4-7,9-10H2,1-3H3/t11-,13+,14+,15+,17-,18+,19-,21-,22-,23+,24+/m0/s1
| Molecular Formula | C24H32O8 |
| Molecular Weight | 448.5061 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 10 / 11 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 09:11:13 GMT 2023
by
admin
on
Sat Dec 16 09:11:13 GMT 2023
|
| Record UNII |
VSC965W7CY
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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156028070
Created by
admin on Sat Dec 16 09:11:13 GMT 2023 , Edited by admin on Sat Dec 16 09:11:13 GMT 2023
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VSC965W7CY
Created by
admin on Sat Dec 16 09:11:13 GMT 2023 , Edited by admin on Sat Dec 16 09:11:13 GMT 2023
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674781-22-7
Created by
admin on Sat Dec 16 09:11:13 GMT 2023 , Edited by admin on Sat Dec 16 09:11:13 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
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PARENT -> METABOLITE |
MINOR
FECAL
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