Chem
J-GLOBAL ID：200907068270044585   Nikkaji number：J14.000G

Vittatine

ビッタチン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C16H17NO3
Molecular formula furigana： C16-H17-N-O3
Molecular weight： 271.316
InChI： InChI=1S/C16H17NO3/c18-11-1-2-16-3-4-17(15(16)6-11)8-10-5-13-14(7-12(10)16)20-9-19-13/h1-2,5,7,11,15,18H,3-4,6,8-9H2/t11-,15+,16+/m1/s1
InChI key： RPAORVSEYNOMBR-RLCCDNCMSA-N
SMILES： O[C@H]1C[C@@H]2N3CC[C@@]2(C=C1)c1cc2OCOc2cc1C3
Systematic name  (2)：
  • [5R,13β,19R,(+)]-1,2-ジデヒドロクリナン-3β-オール
  • (5R,13β,19R)-1,2-ジデヒドロクリナン-3β-オール
Other name (7)：
  • ビタチン
  • ビッタチン
  • Vittatine
  • [5R,13β,19R,(+)]-1,2-Didehydrocrinan-3β-ol
  • (5R,13β,19R)-1,2-Didehydrocrinan-3β-ol
Show all
CAS registry number： 510-69-0
KEGG COMPOUND： C12193
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