Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C22H29N3O6S.C13H19NO4S |
| Molecular Weight | 748.906 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CCCN(CCC)S(=O)(=O)C1=CC=C(C=C1)C(O)=O.[H][C@]23SC(C)(C)[C@@H](N2C(=O)[C@H]3NC(=O)[C@H](N)C4=CC=CC=C4)C(=O)OCOC(=O)C(C)(C)C
InChI
InChIKey=LKZFWYIOFQDUMO-GLCLSGQWSA-N
InChI=1S/C22H29N3O6S.C13H19NO4S/c1-21(2,3)20(29)31-11-30-19(28)15-22(4,5)32-18-14(17(27)25(15)18)24-16(26)13(23)12-9-7-6-8-10-12;1-3-9-14(10-4-2)19(17,18)12-7-5-11(6-8-12)13(15)16/h6-10,13-15,18H,11,23H2,1-5H3,(H,24,26);5-8H,3-4,9-10H2,1-2H3,(H,15,16)/t13-,14-,15+,18-;/m1./s1
Approval Year
| Name | Type | Language | ||
|---|---|---|---|---|
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Official Name | English | ||
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Common Name | English |
| Classification Tree | Code System | Code | ||
|---|---|---|---|---|
|
NCI_THESAURUS |
C1500
Created by
admin on Fri Dec 15 15:38:52 UTC 2023 , Edited by admin on Fri Dec 15 15:38:52 UTC 2023
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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42190-91-0
Created by
admin on Fri Dec 15 15:38:52 UTC 2023 , Edited by admin on Fri Dec 15 15:38:52 UTC 2023
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PRIMARY | |||
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C012649
Created by
admin on Fri Dec 15 15:38:52 UTC 2023 , Edited by admin on Fri Dec 15 15:38:52 UTC 2023
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PRIMARY | |||
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M3MYK6R22U
Created by
admin on Fri Dec 15 15:38:52 UTC 2023 , Edited by admin on Fri Dec 15 15:38:52 UTC 2023
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PRIMARY | |||
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DTXSID00195021
Created by
admin on Fri Dec 15 15:38:52 UTC 2023 , Edited by admin on Fri Dec 15 15:38:52 UTC 2023
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PRIMARY | |||
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65322
Created by
admin on Fri Dec 15 15:38:52 UTC 2023 , Edited by admin on Fri Dec 15 15:38:52 UTC 2023
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PRIMARY | |||
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C66441
Created by
admin on Fri Dec 15 15:38:52 UTC 2023 , Edited by admin on Fri Dec 15 15:38:52 UTC 2023
|
PRIMARY |
ACTIVE MOIETY
PARENT (SALT/SOLVATE)
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD
