Erythratidine; O16-De-Me 

AlkaPlorer ID: AK297827

Synonym: Erysotine

IUPAC Name: 2,12-dimethoxy-2,3,5,6,8,9-hexahydro-1H-indolo[7a,1-a]isoquinoline-3,11-diol

Structure

SMILES: COC1=C(O)C=C2CCN3CCC4=CC(O)C(OC)CC43C2=C1

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InChI: InChI=1S/C18H23NO4/c1-22-16-9-13-11(7-14(16)20)3-5-19-6-4-12-8-15(21)17(23-2)10-18(12,13)19/h7-9,15,17,20-21H,3-6,10H2,1-2H3

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InChIKey: HPQCIRWCBBADDQ-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 317.38500000000005

TPSA: 62.16000000000001

MolLogP: 1.5638999999999998

Number of H-Donors: 2

Number of H-Acceptors: 5

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information