Xylopinine

AlkaPlorer ID: AK002812

Synonym: 'Berbine, 2,3,10,11-tetramethoxy-', 'Tetrahydropseudopalmatine', 'S-(-)-Xylopinine', '6H-Dibenzoa,gquinolizine, 5,8,13,13a-tetrahydro-2,3,10,11-tetramethoxy-', 'O,O-Dimethylgovadine', '2,3,10,11-Tetramethoxyberbine', 'MLS002638117', 'Xylopinine', 'O-Methylgovanine', 'BERBINE, 2,3-10,11-TETRAMETHOXY-, HYDRATE', 'SMR001547608', 'Norcoralydine', 'MLSMR'

IUPAC Name: (13aR)-2,3,10,11-tetramethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline

Structure

SMILES: COC1=C(OC)C=C2CN3CCC4=C(C=C(OC)C(OC)=C4)[C@H]3CC2=C1

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InChI: InChI=1S/C21H25NO4/c1-23-18-8-13-5-6-22-12-15-10-20(25-3)19(24-2)9-14(15)7-17(22)16(13)11-21(18)26-4/h8-11,17H,5-7,12H2,1-4H3/t17-/m1/s1

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InChIKey: YOAUKNYXWBTMMF-QGZVFWFLSA-N

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Properties Information

Molecule Weight: 355.4340000000001

TPSA: 40.16

MolLogP: 3.376500000000002

Number of H-Donors: 0

Number of H-Acceptors: 5

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information