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Substance Name: Ro 12-2503
RN: 81844-75-9
InChIKey: SIBYCALNINYGII-XBQBLZITSA-N

Molecular Weight

  • 384.513
 
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Names and Synonyms

Name of Substance

  • Ro 12-2503

Synonym

  • 17alpha-Hydroxy-6beta,7beta-methylene-3-oxo-D-homo-17aalpha-pregna-4,16-dien-21-carboxylic acid

Systematic Name

  • 3'H-Cyclopropa(6,7)-D-homopregna-4,6,16-triene-21-carboxylic acid, 6,7-dihydro-17a-hydroxy-3-oxo-, (6alpha,7alpha,17aalpha)-

Registry Numbers

CAS Registry Number

  • 81844-75-9

System Generated Number

  • 0081844759

Structure Descriptors

InChI

1S/C24H32O4/c1-22-9-5-14(25)12-19(22)15-13-16(15)21-17(22)6-10-23(2)18(21)4-3-8-24(23,28)11-7-20(26)27/h3,8,12,15-18,21,28H,4-7,9-11,13H2,1-2H3,(H,26,27)/t15-,16+,17+,18+,21-,22-,23+,24-/m1/s1

InChIKey

SIBYCALNINYGII-XBQBLZITSA-N

Smiles

C1C(=O)C=C2[C@H]3[C@H]([C@@H]4[C@@H]([C@@]2(C1)C)CC[C@@]1([C@@](C=CC[C@@H]41)(CCC(=O)O)O)C)C3