Chem
J-GLOBAL ID:200907003099267460
Nikkaji number:J8.848J
Magnoline
マグノリン
Download MOL file
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:
C36 H40 N2 O6
Molecular formula furigana:
C36-H40-N2-O6
Molecular weight:
596.724
InChI:
InChI=1S/C36H40N2O6/c1-37-13-11-24-18-34(42-3)32(40)20-27(24)29(37)15-22-5-8-26(9-6-22)44-36-17-23(7-10-31(36)39)16-30-28-21-33(41)35(43-4)19-25(28)12-14-38(30)2/h5-10,17-21,29-30,39-41H,11-16H2,1-4H3/t29-,30+/m1/s1
InChI key:
FDABVSXGAMFQQH-IHLOFXLRSA-N
SMILES:
COc1cc2CCN(C)[C@H](Cc3ccc(Oc4cc(C[C@@H]5N(C)CCc6cc(OC)c(O)cc56)ccc4O)cc3)c2cc1O
Systematic name (3):
(1R)-1,2,3,4-テトラヒドロ-1-[[4-[2-ヒドロキシ-5-[[(1S)-1,2,3,4-テトラヒドロ-7-ヒドロキシ-6-メトキシ-2-メチルイソキノリン-1-イル]メチル]フェノキシ]フェニル]メチル]-6-メトキシ-2-メチルイソキノリン-7-オール
(1R)-1-{[4-(2-ヒドロキシ-5-{[(1S)-7-ヒドロキシ-6-メトキシ-2-メチル-1,2,3,4-テトラヒドロイソキノリン-1-イル]メチル}フェノキシ)フェニル]メチル}-6-メトキシ-2-メチル-1,2,3,4-テトラヒドロイソキノリン-7-オール
(1R)-1-{[4-(2-hydroxy-5-{[(1S)-7-hydroxy-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl}phenoxy)phenyl]methyl}-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol
Other name (3):
マグノリン
Magnoline
(1R)-1,2,3,4-Tetrahydro-1-[[4-[2-hydroxy-5-[[(1S)-1,2,3,4-tetrahydro-7-hydroxy-6-methoxy-2-methylisoquinolin-1-yl]methyl]phenoxy]phenyl]methyl]-6-methoxy-2-methylisoquinolin-7-ol
CAS registry number:
6859-66-1
Thsaurus map:
Return to Previous Page