1,2,10,11,12-Pentahydroxyhomoaporphine; (R)-form, 2,10,12-Tri-Me ether 

AlkaPlorer ID: AK309677

Synonym: Multifloramine

IUPAC Name: 3,5,16-trimethoxy-11-methyl-11-azatetracyclo[8.7.1.02,7.014,18]octadeca-1(18),2,4,6,14,16-hexaene-4,17-diol

Structure

SMILES: COC1=CC2=C(C(OC)=C1O)C1=C(O)C(OC)=CC3=C1C(CC2)N(C)CC3

copy

InChI: InChI=1S/C21H25NO5/c1-22-8-7-12-10-14(25-2)19(23)18-16(12)13(22)6-5-11-9-15(26-3)20(24)21(27-4)17(11)18/h9-10,13,23-24H,5-8H2,1-4H3

copy

InChIKey: JCWDQBQBVNMMNK-UHFFFAOYSA-N

copy

Reference

PubChem CID: 12312985

CAS: 22324-16-9

COCONUT: CNP0275453.1

Properties Information

Molecule Weight: 371.4330000000002

TPSA: 71.39

MolLogP: 3.2658000000000014

Number of H-Donors: 2

Number of H-Acceptors: 6

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information