Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C27H31N5O8S2 |
| Molecular Weight | 617.694 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=C(C(=O)N[C@@H]([C@@H]2N[C@@H](C(O)=O)C(C)(C)S2)C(=O)N[C@H]3[C@H]4SC(C)(C)[C@@H](N4C3=O)C(O)=O)C(=NO1)C5=CC=CC=C5
InChI
InChIKey=VPSGOHMBUXSFMC-KCPUJOARSA-N
InChI=1S/C27H31N5O8S2/c1-11-13(14(31-40-11)12-9-7-6-8-10-12)19(33)28-15(21-30-17(24(36)37)26(2,3)41-21)20(34)29-16-22(35)32-18(25(38)39)27(4,5)42-23(16)32/h6-10,15-18,21,23,30H,1-5H3,(H,28,33)(H,29,34)(H,36,37)(H,38,39)/t15-,16-,17+,18+,21-,23-/m1/s1
| Molecular Formula | C27H31N5O8S2 |
| Molecular Weight | 617.694 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 23:23:29 GMT 2025
by
admin
on
Mon Mar 31 23:23:29 GMT 2025
|
| Record UNII |
39UU58R6KU
|
| 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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Common Name | English |
| Code System | Code | Type | Description | ||
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139024605
Created by
admin on Mon Mar 31 23:23:29 GMT 2025 , Edited by admin on Mon Mar 31 23:23:29 GMT 2025
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PRIMARY | |||
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39UU58R6KU
Created by
admin on Mon Mar 31 23:23:29 GMT 2025 , Edited by admin on Mon Mar 31 23:23:29 GMT 2025
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> IMPURITY |
CHROMATOGRAPHIC PURITY (HPLC/UV)
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|
