Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C32H53N3O11 |
| Molecular Weight | 655.7767 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 9 / 9 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=C(O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)C=C(C[C@@H](C[C@H](N)[C@@H](O)C[C@@H](C(C)C)C(=O)NCC(C)(C)C(N)=O)C(C)C)C=C1
InChI
InChIKey=NYEBHWKRRSTHJB-LFOPDFBESA-N
InChI=1S/C32H53N3O11/c1-15(2)18(12-20(33)21(36)13-19(16(3)4)28(40)35-14-32(5,6)31(34)43)10-17-8-9-22(44-7)23(11-17)45-30-26(39)24(37)25(38)27(46-30)29(41)42/h8-9,11,15-16,18-21,24-27,30,36-39H,10,12-14,33H2,1-7H3,(H2,34,43)(H,35,40)(H,41,42)/t18-,19-,20-,21-,24-,25-,26+,27-,30+/m0/s1
| Molecular Formula | C32H53N3O11 |
| Molecular Weight | 655.7767 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 9 / 9 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 04:47:59 GMT 2025
by
admin
on
Wed Apr 02 04:47:59 GMT 2025
|
| Record UNII |
FK994FE8SE
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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949925-78-4
Created by
admin on Wed Apr 02 04:47:59 GMT 2025 , Edited by admin on Wed Apr 02 04:47:59 GMT 2025
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FK994FE8SE
Created by
admin on Wed Apr 02 04:47:59 GMT 2025 , Edited by admin on Wed Apr 02 04:47:59 GMT 2025
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156028142
Created by
admin on Wed Apr 02 04:47:59 GMT 2025 , Edited by admin on Wed Apr 02 04:47:59 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE |
URINE
|
