(6aR,12aR)-2,9-dimethoxy-5,6,6a,7,12,12a-hexahydro-6-azatetraphene-3,8-diol

AlkaPlorer ID: AK366143

Synonym: None

IUPAC Name: 2,9-dimethoxy-5,6,6a,7,12,12a-hexahydrobenzo[b]phenanthridine-3,8-diol

Structure

SMILES: COC1=CC2=C(C=C1O)CNC1CC3=C(O)C(OC)=CC=C3CC21

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InChI: InChI=1S/C19H21NO4/c1-23-17-4-3-10-5-14-12-8-18(24-2)16(21)6-11(12)9-20-15(14)7-13(10)19(17)22/h3-4,6,8,14-15,20-22H,5,7,9H2,1-2H3

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InChIKey: DJRZPPQHJDVOQW-UHFFFAOYSA-N

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Reference

Argemone alkaloids

PubChem CID: 163025141

LOTUS: LTS0065786

COCONUT: CNP0302582.1

Source

Properties Information

Molecule Weight: 327.38000000000005

TPSA: 70.95

MolLogP: 2.4692000000000007

Number of H-Donors: 3

Number of H-Acceptors: 5

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information