Akagerine; 10-Hydroxy, 17-Me ether

AlkaPlorer ID: AK283623

Synonym: 10-Hydroxy-17-O-methylakagerine 

IUPAC Name: None

Structure

SMILES: C/C=C(/C=O)C1CC2C3=C(CCN2C)C2=C(C=CC(O)=C2)N3C(OC)C1

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InChI: InChI=1S/C21H26N2O3/c1-4-13(12-24)14-9-19-21-16(7-8-22(19)2)17-11-15(25)5-6-18(17)23(21)20(10-14)26-3/h4-6,11-12,14,19-20,25H,7-10H2,1-3H3/b13-4-

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InChIKey: KQIJOWWBWNZTPC-PQMHYQBVSA-N

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Reference

CAS: 73360-05-1

Source

Properties Information

Molecule Weight: 354.45000000000005

TPSA: 54.7

MolLogP: 3.576100000000003

Number of H-Donors: 1

Number of H-Acceptors: 5

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information