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Substance Name: 1-Phenanthrenecarboxylic acid, 6,8-dichloro-1,2,3,4,4a,9,10,10a-octahydro-7-(2-hydroxy-1-methylethyl)-1,4a-dimethyl-3-oxo-, methyl ester, (1R-(1alpha,4abeta,7(S*),10aalpha))-
RN: 86547-16-2
InChIKey: NPVDXAYIRWGVRT-JVENELCASA-N

Molecular Formula

  • C21-H26-Cl2-O4

Molecular Weight

  • 413.338
 
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Names and Synonyms

  • 1-Phenanthrenecarboxylic acid, 6,8-dichloro-1,2,3,4,4a,9,10,10a-octahydro-7-(2-hydroxy-1-methylethyl)-1,4a-dimethyl-3-oxo-, methyl ester, (1R-(1alpha,4abeta,7(S*),10aalpha))-

Registry Numbers

CAS Registry Number

  • 86547-16-2

System Generated Number

  • 0086547162

Structure Descriptors

InChI

1S/C21H26Cl2O4/c1-11(10-24)17-15(22)7-14-13(18(17)23)5-6-16-20(14,2)8-12(25)9-21(16,3)19(26)27-4/h7,11,16,24H,5-6,8-10H2,1-4H3/t11-,16-,20-,21-/m1/s1

InChIKey

NPVDXAYIRWGVRT-JVENELCASA-N

Smiles

C1(=O)C[C@@](C)(C(=O)OC)[C@@H]2CCc3c([C@@]2(C)C1)cc(c(c3Cl)[C@H](C)CO)Cl