Chem
J-GLOBAL ID：200907044475146015   Nikkaji number：J16.051B

Isomatrine

イソマトリン
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： C15H24N2O
Molecular formula furigana： C15-H24-N2-O
Molecular weight： 248.370
InChI： InChI=1S/C15H24N2O/c18-14-7-1-6-13-12-5-3-9-16-8-2-4-11(15(12)16)10-17(13)14/h11-13,15H,1-10H2/t11-,12+,13-,15-/m1/s1
InChI key： ZSBXGIUJOOQZMP-QVHKTLOISA-N
SMILES： O=C1CCC[C@@H]2[C@@H]3CCCN4CCC[C@H](CN12)[C@H]34
Systematic name  (3)：
  • (5β,6β,7β)-マトリジン-15-オン
  • (1S,2R,9R,17R)-7,13-ジアザテトラシクロ[7.7.1.02,7.013,17]ヘプタデカン-6-オン
  • (1S,2R,9R,17R)-7,13-diazatetracyclo[7.7.1.02,7.013,17]heptadecan-6-one
Other name (3)：
  • イソマトリン
  • Isomatrine
  • (5β,6β,7β)-Matridin-15-one
CAS registry number： 17801-36-4
KEGG COMPOUND： C17442
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