Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C32H33N3O13S |
| Molecular Weight | 699.682 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=C(C=C(C=C1C2=CC3=CC=C(NS(C)(=O)=O)C=C3C=C2)N4C=CC(=O)NC4=O)C(C)(C)C(=O)O[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)C(O)=O
InChI
InChIKey=WXLZPCIVNDRUJX-ZGQSFZIASA-N
InChI=1S/C32H33N3O13S/c1-32(2,30(42)48-29-25(39)23(37)24(38)27(47-29)28(40)41)21-14-19(35-10-9-22(36)33-31(35)43)13-20(26(21)46-3)17-6-5-16-12-18(34-49(4,44)45)8-7-15(16)11-17/h5-14,23-25,27,29,34,37-39H,1-4H3,(H,40,41)(H,33,36,43)/t23-,24-,25+,27-,29-/m0/s1
| Molecular Formula | C32H33N3O13S |
| Molecular Weight | 699.682 |
| 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
Sat Dec 16 16:36:00 UTC 2023
by
admin
on
Sat Dec 16 16:36:00 UTC 2023
|
| Record UNII |
5A40TDJ3P0
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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Common Name | English |
| Code System | Code | Type | Description | ||
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5A40TDJ3P0
Created by
admin on Sat Dec 16 16:36:00 UTC 2023 , Edited by admin on Sat Dec 16 16:36:00 UTC 2023
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138455043
Created by
admin on Sat Dec 16 16:36:00 UTC 2023 , Edited by admin on Sat Dec 16 16:36:00 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
PLASMA; URINE
|
