Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C36H40N10O8S |
| Molecular Weight | 772.83 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
C\C(SC[C@H](NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O)=C/C(=O)N1CCC[C@H]1C2=NC(=C3N2C=CN=C3N)C4=CC=C(C=C4)C(=O)NC5=CC=CC=N5
InChI
InChIKey=BICAVMMDZAAEGI-SURFEYQGSA-N
InChI=1S/C36H40N10O8S/c1-20(55-19-24(35(52)41-18-29(49)50)42-27(47)12-11-23(37)36(53)54)17-28(48)45-15-4-5-25(45)33-44-30(31-32(38)40-14-16-46(31)33)21-7-9-22(10-8-21)34(51)43-26-6-2-3-13-39-26/h2-3,6-10,13-14,16-17,23-25H,4-5,11-12,15,18-19,37H2,1H3,(H2,38,40)(H,41,52)(H,42,47)(H,49,50)(H,53,54)(H,39,43,51)/b20-17+/t23-,24-,25-/m0/s1
| Molecular Formula | C36H40N10O8S |
| Molecular Weight | 772.83 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 1 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 14:43:02 GMT 2023
by
admin
on
Sat Dec 16 14:43:02 GMT 2023
|
| Record UNII |
938V97KYR4
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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156613872
Created by
admin on Sat Dec 16 14:43:02 GMT 2023 , Edited by admin on Sat Dec 16 14:43:02 GMT 2023
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938V97KYR4
Created by
admin on Sat Dec 16 14:43:02 GMT 2023 , Edited by admin on Sat Dec 16 14:43:02 GMT 2023
|
PRIMARY |
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