Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C21H27O8S.Na |
Molecular Weight | 462.489 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 6 / 6 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[H][C@@]12CC[C@](O)(C(=O)COS([O-])(=O)=O)[C@@]1(C)CC(=O)[C@@]3([H])[C@@]2([H])CCC4=CC(=O)CC[C@]34C
InChI
InChIKey=CKCQAVLXEMPVTM-HNGAPHHWSA-M
InChI=1S/C21H28O8S.Na/c1-19-7-5-13(22)9-12(19)3-4-14-15-6-8-21(25,17(24)11-29-30(26,27)28)20(15,2)10-16(23)18(14)19;/h9,14-15,18,25H,3-8,10-11H2,1-2H3,(H,26,27,28);/q;+1/p-1/t14-,15-,18+,19-,20-,21-;/m0./s1
Approval Year
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Code | English | ||
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Code System | Code | Type | Description | ||
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10Y95B632Z
Created by
admin on Sat Dec 16 00:40:36 GMT 2023 , Edited by admin on Sat Dec 16 00:40:36 GMT 2023
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PRIMARY | |||
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71586795
Created by
admin on Sat Dec 16 00:40:36 GMT 2023 , Edited by admin on Sat Dec 16 00:40:36 GMT 2023
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PRIMARY | |||
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2681-67-6
Created by
admin on Sat Dec 16 00:40:36 GMT 2023 , Edited by admin on Sat Dec 16 00:40:36 GMT 2023
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PRIMARY | |||
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15464
Created by
admin on Sat Dec 16 00:40:36 GMT 2023 , Edited by admin on Sat Dec 16 00:40:36 GMT 2023
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PRIMARY |
SUBSTANCE RECORD