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Substance Name: 9,10-Dihydroxy-9,10-dihydro-3-methylcholanthrene-2-one
RN: 127861-40-9
InChIKey: UALOIRUKSTWXFU-UHFFFAOYSA-N

Molecular Formula

  • C21-H16-O3

Molecular Weight

  • 316.354
 
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Names and Synonyms

Name of Substance

  • 9,10-Dihydroxy-9,10-dihydro-3-methylcholanthrene-2-one

Synonym

  • 9,10-Dihydroxy-3MC-2-one

Systematic Name

  • Benz(j)aceanthrylen-2(1H)-one, 9,10-dihydro-9,10-dihydroxy-3-methyl-, (9R-trans)-

Registry Numbers

CAS Registry Number

  • 127861-40-9

System Generated Number

  • 0127861409

Structure Descriptors

InChI

1S/C21H16O3/c1-10-2-3-11-8-15-12-6-7-17(22)21(24)14(12)5-4-13(15)16-9-18(23)19(10)20(11)16/h2-8,17,21-22,24H,9H2,1H3

InChIKey

UALOIRUKSTWXFU-UHFFFAOYSA-N

Smiles

C1C(c2c(ccc3cc4c5C=C[C@@H]([C@@H](c5ccc4c1c23)O)O)C)=O