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Substance Name: Ro 46-8515
RN: 153049-52-6
InChIKey: KBIAFYRDJJEKBF-UHFFFAOYSA-N

Note

  • A retinoic acid receptor alpha antagonist.

Molecular Formula

  • C29-H34-O5-S

Molecular Weight

  • 494.649
 
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Names and Synonyms

Name of Substance

  • Ro 46-8515

Synonyms

  • 6-(7-(Heptyloxy)-3,4-dihydro -4,4-dimethyl-1,1-dioxido-2H-1-benzothiopyran-6-yl)-2-naphthalenecarboxylic acid
  • Ro-46-8515

Systematic Names

  • 2-Naphthalenecarboxylic acid, 6-(7-(heptyloxy)-3,4-dihydro -4,4-dimethyl-1,1-dioxido-2H-1-benzothiopyran-6-yl)-
  • 2-Naphthalenecarboxylic acid, 6-(7-(heptyloxy)-3,4-dihydro-4,4-dimethyl-2H-1-benzopyran-6-yl)-, S,S-dioxide

Registry Numbers

CAS Registry Number

  • 153049-52-6

System Generated Number

  • 0153049526

Structure Descriptors

InChI

1S/C29H34O5S/c1-4-5-6-7-8-14-34-26-19-27-25(29(2,3)13-15-35(27,32)33)18-24(26)22-11-9-21-17-23(28(30)31)12-10-20(21)16-22/h9-12,16-19H,4-8,13-15H2,1-3H3,(H,30,31)

InChIKey

KBIAFYRDJJEKBF-UHFFFAOYSA-N

Smiles

c1(c2c(OCCCCCCC)cc3S(CCC(C)(C)c3c2)(=O)=O)ccc2c(ccc(c2)C(O)=O)c1