Curine; (-)-form, Di-Me ether

AlkaPlorer ID: AK293363

Synonym: O,O-Dimethyl-(-)-curine, Paraquileginine 

IUPAC Name: None

Structure

SMILES: COC1=CC=C2C=C1OC1=CC=C3C(=C1OC)CCN(C)C3CC1=CC=C(C=C1)OC1=C(OC)C(OC)=CC3=C1C(C2)N(C)CC3

copy

InChI: InChI=1S/C38H42N2O6/c1-39-18-16-28-27-12-14-32(36(28)43-5)46-33-21-24(9-13-31(33)41-3)20-30-35-25(15-17-40(30)2)22-34(42-4)37(44-6)38(35)45-26-10-7-23(8-11-26)19-29(27)39/h7-14,21-22,29-30H,15-20H2,1-6H3

copy

InChIKey: MKHXBIFOEGFHTJ-UHFFFAOYSA-N

copy

Reference

CAS: 1812-55-1

Source

Properties Information

Molecule Weight: 622.762

TPSA: 61.86000000000001

MolLogP: 7.162400000000009

Number of H-Donors: 0

Number of H-Acceptors: 8

RingCount: 9

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information