Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C31H33N3O10S |
| Molecular Weight | 639.673 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CCOC1=NN(CC2=CC=C(OCC3=CSC(=N3)C4=CC=CC=C4)C=C2)C=C1CCC(=O)O[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)C(O)=O
InChI
InChIKey=CGBMFATZQUJBFD-KWONYSJQSA-N
InChI=1S/C31H33N3O10S/c1-2-41-28-20(10-13-23(35)43-31-26(38)24(36)25(37)27(44-31)30(39)40)15-34(33-28)14-18-8-11-22(12-9-18)42-16-21-17-45-29(32-21)19-6-4-3-5-7-19/h3-9,11-12,15,17,24-27,31,36-38H,2,10,13-14,16H2,1H3,(H,39,40)/t24-,25-,26+,27-,31+/m0/s1
| Molecular Formula | C31H33N3O10S |
| Molecular Weight | 639.673 |
| 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 16:54:35 GMT 2023
by
admin
on
Sat Dec 16 16:54:35 GMT 2023
|
| Record UNII |
12DMB1Q1BG
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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| Code System | Code | Type | Description | ||
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1416621-09-4
Created by
admin on Sat Dec 16 16:54:35 GMT 2023 , Edited by admin on Sat Dec 16 16:54:35 GMT 2023
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118753042
Created by
admin on Sat Dec 16 16:54:35 GMT 2023 , Edited by admin on Sat Dec 16 16:54:35 GMT 2023
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12DMB1Q1BG
Created by
admin on Sat Dec 16 16:54:35 GMT 2023 , Edited by admin on Sat Dec 16 16:54:35 GMT 2023
|
PRIMARY |
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IN VITRO
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