Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | 2C20H26NO4S.Ca |
| Molecular Weight | 793.057 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 8 / 8 |
| E/Z Centers | 2 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Ca++].[O-]C(=O)CCC\C=C/C[C@H]1[C@@H]2CC[C@@H](C2)[C@@H]1NS(=O)(=O)C3=CC=CC=C3.[O-]C(=O)CCC\C=C/C[C@H]4[C@@H]5CC[C@@H](C5)[C@@H]4NS(=O)(=O)C6=CC=CC=C6
InChI
InChIKey=CWOWCGMKFUVBRQ-NBGZWUPPSA-L
InChI=1S/2C20H27NO4S.Ca/c2*22-19(23)11-7-2-1-6-10-18-15-12-13-16(14-15)20(18)21-26(24,25)17-8-4-3-5-9-17;/h2*1,3-6,8-9,15-16,18,20-21H,2,7,10-14H2,(H,22,23);/q;;+2/p-2/b2*6-1-;/t2*15-,16+,18+,20+;/m11./s1
Approval Year
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| Code System | Code | Type | Description | ||
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76967289
Created by
admin on Mon Mar 31 23:37:44 GMT 2025 , Edited by admin on Mon Mar 31 23:37:44 GMT 2025
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PRIMARY | |||
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132747-47-8
Created by
admin on Mon Mar 31 23:37:44 GMT 2025 , Edited by admin on Mon Mar 31 23:37:44 GMT 2025
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151S9A327U
Created by
admin on Mon Mar 31 23:37:44 GMT 2025 , Edited by admin on Mon Mar 31 23:37:44 GMT 2025
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m4735
Created by
admin on Mon Mar 31 23:37:44 GMT 2025 , Edited by admin on Mon Mar 31 23:37:44 GMT 2025
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PRIMARY | Merck Index |
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD
