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Substance Name: Aldosterone 21-sulfate
RN: 52036-29-0
InChIKey: LWCMITUCQRJZGP-ZVIOFETBSA-N

Note

  • Sulfuric acid ester of aldosterone.

Molecular Formula

  • C21-H28-O8-S

Molecular Weight

  • 440.51
 
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Names and Synonyms

Name of Substance

  • Aldosterone 21-sulfate

Systematic Name

  • Pregn-4-en-18-al, 11-hydroxy-3,20-dioxo-21-(sulfooxy)-, (11beta)-

Registry Numbers

CAS Registry Number

  • 52036-29-0

System Generated Number

  • 0052036290

Structure Descriptors

InChI

1S/C21H28O8S/c1-20-7-6-13(23)8-12(20)2-3-14-15-4-5-16(18(25)10-29-30(26,27)28)21(15,11-22)9-17(24)19(14)20/h8,11,14-17,19,24H,2-7,9-10H2,1H3,(H,26,27,28)/t14-,15-,16+,17-,19+,20-,21+/m0/s1

InChIKey

LWCMITUCQRJZGP-ZVIOFETBSA-N

Smiles

C1(CC[C@@]2([C@H]3[C@H](C[C@@]4([C@H](CC[C@@H]4[C@@H]3CCC2=C1)C(COS(=O)(=O)O)=O)C=O)O)C)=O