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Substance Name: 1,2,9,10-Tetrahydro-3-methyl-benz(j)aceanthrylene-1,9,10-triol, (1alpha,9beta,10alpha)-
RN: 65799-05-5
UNII: I97O00N1Y8
InChIKey: HCAPYAKTGHZBKU-DBXWQHBBSA-N

Molecular Weight

  • 318.37
 
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Names and Synonyms

Name of Substance

  • 1,2,9,10-Tetrahydro-3-methyl-benz(j)aceanthrylene-1,9,10-triol, (1alpha,9beta,10alpha)-

Synonyms

  • CCRIS 1294
  • UNII-I97O00N1Y8

Systematic Names

  • 1,9,10-Trihydroxy-9,10-dihydro-3-methylcholanthrene (1-alpha,9-beta,10-alpha)-
  • Benz(j)aceanthrylene-1,9,10-triol, 1,2,9,10-tetrahydro-3-methyl-, (1alpha,9beta,10alpha)-

Registry Numbers

CAS Registry Number

  • 65799-05-5

FDA UNII

  • I97O00N1Y8

System Generated Number

  • 0065799055

Structure Descriptors

InChI

1S/C21H18O3/c1-10-2-3-11-8-16-12-6-7-17(22)21(24)14(12)5-4-13(16)20-18(23)9-15(10)19(11)20/h2-8,17-18,21-24H,9H2,1H3/t17-,18-,21-/m1/s1

InChIKey

HCAPYAKTGHZBKU-DBXWQHBBSA-N

Smiles

C1[C@H](c2c3ccc4[C@H]([C@@H](C=Cc4c3cc3ccc(c1c23)C)O)O)O