6-O-Methylhaemanthidine

AlkaPlorer ID: AK140652

Synonym: '', '6-Methoxycrinamine'

IUPAC Name: (1S,11S,13S,15S,18R)-11,15-dimethoxy-5,7-dioxa-12-azapentacyclo[10.5.2.01,13.02,10.04,8]nonadeca-2,4(8),9,16-tetraen-18-ol

Structure

SMILES: CO[C@@H]1C=C[C@@]23C4=CC5=C(C=C4[C@H](OC)N(C[C@@H]2O)[C@H]3C1)OCO5

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InChI: InChI=1S/C18H21NO5/c1-21-10-3-4-18-12-7-14-13(23-9-24-14)6-11(12)17(22-2)19(8-16(18)20)15(18)5-10/h3-4,6-7,10,15-17,20H,5,8-9H2,1-2H3/t10-,15+,16+,17+,18+/m1/s1

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InChIKey: UTDHPQRGDUUFNN-GTQNRYLJSA-N

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Source

Properties Information

Molecule Weight: 331.3680000000001

TPSA: 60.390000000000015

MolLogP: 1.3316999999999997

Number of H-Donors: 1

Number of H-Acceptors: 6

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information