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Substance Name: Atis-16-ene-2,14-dione, 3-hydroxy-, (3alpha,5beta,8alpha,9beta,10alpha,12alpha)-
RN: 136025-63-3
InChIKey: DSGJNNDCMDMSTM-KKVGBOLFSA-N

Molecular Formula

  • C20-H28-O3

Molecular Weight

  • 316.4382
 
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Names and Synonyms

Synonym

  • NSC 692969

Systematic Name

  • Atis-16-ene-2,14-dione, 3-hydroxy-, (3alpha,5beta,8alpha,9beta,10alpha,12alpha)-

Registry Numbers

CAS Registry Number

  • 136025-63-3

System Generated Number

  • 0136025633

Structure Descriptors

InChI

1S/C20H28O3/c1-11-9-20-6-5-14-18(2,3)17(23)13(21)10-19(14,4)15(20)7-12(11)8-16(20)22/h12,14-15,17,23H,1,5-10H2,2-4H3/t12-,14-,15+,17-,19-,20+/m1/s1

InChIKey

DSGJNNDCMDMSTM-KKVGBOLFSA-N

Smiles

C[C@@]12CC(=O)[C@H](C([C@H]1CC[C@]34[C@H]2C[C@H](CC3=O)C(=C)C4)(C)C)O