Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | 2C21H22N2O2.5H2O.H2O4S |
| Molecular Weight | 856.978 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 12 / 12 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.O.O.O.OS(O)(=O)=O.[H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6C7=C(C=CC=C7)[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H].[H][C@]89C[C@@]%10([H])C%11=CCO[C@@]%12([H])CC(=O)N%13C%14=C(C=CC=C%14)[C@@]8(CCN9C%11)[C@]%13([H])[C@@]%10%12[H]
InChI
InChIKey=FDQUTDUZMOOVST-ZKOSLKCXSA-N
InChI=1S/2C21H22N2O2.H2O4S.5H2O/c2*24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21;1-5(2,3)4;;;;;/h2*1-5,13,16-17,19-20H,6-11H2;(H2,1,2,3,4);5*1H2/t2*13-,16-,17-,19-,20-,21+;;;;;;/m00....../s1
Approval Year
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| Code System | Code | Type | Description | ||
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300000029182
Created by
admin on Fri Dec 15 17:29:33 UTC 2023 , Edited by admin on Fri Dec 15 17:29:33 UTC 2023
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76965789
Created by
admin on Fri Dec 15 17:29:33 UTC 2023 , Edited by admin on Fri Dec 15 17:29:33 UTC 2023
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3D8109DYZ8
Created by
admin on Fri Dec 15 17:29:33 UTC 2023 , Edited by admin on Fri Dec 15 17:29:33 UTC 2023
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DTXSID40975900
Created by
admin on Fri Dec 15 17:29:33 UTC 2023 , Edited by admin on Fri Dec 15 17:29:33 UTC 2023
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60491-10-3
Created by
admin on Fri Dec 15 17:29:33 UTC 2023 , Edited by admin on Fri Dec 15 17:29:33 UTC 2023
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PRIMARY |
ACTIVE MOIETY
SUBSTANCE RECORD
