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Substance Name: 2-Methoxyequilin
RN: 116506-46-8
InChIKey: SDAPOCMGOIRGRQ-ODYMNIRHSA-N

Molecular Formula

  • C19-H22-O3

Molecular Weight

  • 298.3798
 
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Names and Synonyms

Name of Substance

  • 2-Methoxyequilin

Synonym

  • 3-Hydroxy-2-methoxyestra-1,3,5(10),7-tetraen-17-one

Systematic Name

  • Estra-1,3,5(10),7-tetraen-17-one, 3-hydroxy-2-methoxy-

Registry Numbers

CAS Registry Number

  • 116506-46-8

System Generated Number

  • 0116506468

Structure Descriptors

InChI

1S/C19H22O3/c1-19-8-7-12-13(15(19)5-6-18(19)21)4-3-11-9-16(20)17(22-2)10-14(11)12/h4,9-10,12,15,20H,3,5-8H2,1-2H3/t12-,15-,19-/m0/s1

InChIKey

SDAPOCMGOIRGRQ-ODYMNIRHSA-N

Smiles

C[C@]12CC[C@@H]3c4cc(c(cc4CC=C3[C@@H]1CCC2=O)O)OC