Chem
J-GLOBAL ID：200907070677271718   Nikkaji number：J9.104I

Lophophorine

ロホホリン
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： C13H17NO3
Molecular formula furigana： C13-H17-N-O3
Molecular weight： 235.283
InChI： InChI=1S/C13H17NO3/c1-8-11-9(4-5-14(8)2)6-10(15-3)12-13(11)17-7-16-12/h6,8H,4-5,7H2,1-3H3/t8-/m0/s1
InChI key： PNFBXEKHLUDPIM-QMMMGPOBSA-N
SMILES： COc1cc2CCN(C)[C@@H](C)c2c2OCOc12
Systematic name  (3)：
  • (9S)-6,7,8,9-テトラヒドロ-4-メトキシ-8,9-ジメチル-1,3-ジオキソロ[4,5-h]イソキノリン
  • (9S)-4-メトキシ-8,9-ジメチル-2H,6H,7H,8H,9H-[1,3]ジオキソロ[4,5-h]イソキノリン
  • (9S)-4-methoxy-8,9-dimethyl-2H,6H,7H,8H,9H-[1,3]dioxolo[4,5-h]isoquinoline
Other name (5)：
  • ロホホリン
  • Lophophorine
  • N-メチルアンタロニン
  • N-Methylanthalonine
  • (9S)-6,7,8,9-Tetrahydro-4-methoxy-8,9-dimethyl-1,3-dioxolo[4,5-h]isoquinoline
CAS registry number： 17627-78-0
Regulation number (1)：
  • JI4800000
KEGG COMPOUND： C09573
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