Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C12H20N4O6S.H2O |
| Molecular Weight | 366.391 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.OS(=O)(=O)ON1[C@H]2C[N@]([C@@H](CC2)C(=O)NC3CCNCC3)C1=O
InChI
InChIKey=TWFRCSHLWKJBQH-UXQCFNEQSA-N
InChI=1S/C12H20N4O6S.H2O/c17-11(14-8-3-5-13-6-4-8)10-2-1-9-7-15(10)12(18)16(9)22-23(19,20)21;/h8-10,13H,1-7H2,(H,14,17)(H,19,20,21);1H2/t9-,10+;/m1./s1
Approval Year
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C258
Created by
admin on Sat Dec 16 10:54:44 UTC 2023 , Edited by admin on Sat Dec 16 10:54:44 UTC 2023
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| Code System | Code | Type | Description | ||
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100000179908
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SUB194532
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5342
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2184137
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1174020-13-3
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BC-74
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2184136
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DB12377
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Y1MYA2UHFL
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76900350
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C152176
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CHEMBL3112741
Created by
admin on Sat Dec 16 10:54:44 UTC 2023 , Edited by admin on Sat Dec 16 10:54:44 UTC 2023
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PRIMARY |
ACTIVE MOIETY
SUBSTANCE RECORD