Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C31H31N5O13S4 |
| Molecular Weight | 809.864 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CO[C@]2(NC(=O)CC1=CC=CS1)[C@H]3SCC(CONC(=O)OCC4=C(N5[C@H](SC4)[C@@](NC(=O)CC6=CC=CS6)(OC)C5=O)C(O)=O)=C(N3C2=O)C(O)=O
InChI
InChIKey=OBPSVGGPPYBVQV-NTXZQFRFSA-N
InChI=1S/C31H31N5O13S4/c1-46-30(32-19(37)9-17-5-3-7-50-17)25(43)35-21(23(39)40)15(13-52-27(30)35)11-48-29(45)34-49-12-16-14-53-28-31(47-2,26(44)36(28)22(16)24(41)42)33-20(38)10-18-6-4-8-51-18/h3-8,27-28H,9-14H2,1-2H3,(H,32,37)(H,33,38)(H,34,45)(H,39,40)(H,41,42)/t27-,28-,30+,31+/m1/s1
| Molecular Formula | C31H31N5O13S4 |
| Molecular Weight | 809.864 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 17:10:05 GMT 2025
by
admin
on
Wed Apr 02 17:10:05 GMT 2025
|
| Record UNII |
32YW9CT2XC
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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Common Name | English | ||
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Preferred Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
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168429511
Created by
admin on Wed Apr 02 17:10:05 GMT 2025 , Edited by admin on Wed Apr 02 17:10:05 GMT 2025
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PRIMARY | |||
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32YW9CT2XC
Created by
admin on Wed Apr 02 17:10:05 GMT 2025 , Edited by admin on Wed Apr 02 17:10:05 GMT 2025
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PRIMARY |
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PARENT -> IMPURITY |
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