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Substance Name: 3beta,17alpha-Dihydroxypregn-5-ene-21-carboxylic acid gamma-lactone
RN: 13934-61-7
InChIKey: XBSQQVJXPODPRW-ANWZHMNCSA-N

Molecular Formula

  • C22-H32-O3

Molecular Weight

  • 344.4918
 
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Names and Synonyms

Synonym

  • EINECS 237-709-1

Systematic Name

  • 3beta,17alpha-Dihydroxypregn-5-ene-21-carboxylic acid gamma-lactone

Registry Numbers

CAS Registry Number

  • 13934-61-7

System Generated Number

  • 0013934617

Structure Descriptors

InChI

1S/C22H32O3/c1-20-9-5-15(23)13-14(20)3-4-16-17(20)6-10-21(2)18(16)7-11-22(21)12-8-19(24)25-22/h3,15-18,23H,4-13H2,1-2H3/t15-,16+,17-,18-,20-,21-,22+/m0/s1

InChIKey

XBSQQVJXPODPRW-ANWZHMNCSA-N

Smiles

C[C@]12CC[C@@H](CC1=CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@]45CCC(=O)O5)C)O