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Substance Name: Pregna-1,4-diene-20-carboxylic acid, 12-hydroxy-3-oxo-, (12alpha)-
RN: 59476-83-4
InChIKey: GOJFQAWHNZEBKB-FETJCDNZSA-N

Molecular Formula

  • C22-H3O-O4

Molecular Weight

  • 358.475
 
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Names and Synonyms

  • Pregna-1,4-diene-20-carboxylic acid, 12-hydroxy-3-oxo-, (12alpha)-

Registry Numbers

CAS Registry Number

  • 59476-83-4

System Generated Number

  • 0059476834

Structure Descriptors

InChI

1S/C22H30O4/c1-12(20(25)26)16-6-7-17-15-5-4-13-10-14(23)8-9-21(13,2)18(15)11-19(24)22(16,17)3/h8-10,12,15-19,24H,4-7,11H2,1-3H3,(H,25,26)/t12?,15-,16+,17-,18-,19-,21-,22+/m0/s1

InChIKey

GOJFQAWHNZEBKB-FETJCDNZSA-N

Smiles

CC([C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2CCC4=CC(=O)C=C[C@]34C)O)C)C(=O)O