Pukateine; (R)-form, N-De-Me 

AlkaPlorer ID: AK311620

Synonym: 11-Hydroxy-1,2-methylenedioxynoraporphine, Obovanine

IUPAC Name: 3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1(20),2(6),7,14(19),15,17-hexaen-18-ol

Structure

SMILES: OC1=CC=CC2=C1C1=C3OCOC3=CC3=C1C(C2)NCC3

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InChI: InChI=1S/C17H15NO3/c19-12-3-1-2-9-6-11-14-10(4-5-18-11)7-13-17(21-8-20-13)16(14)15(9)12/h1-3,7,11,18-19H,4-6,8H2

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InChIKey: JBFZNWJDRCJITD-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 281.31100000000004

TPSA: 50.72

MolLogP: 2.5308

Number of H-Donors: 2

Number of H-Acceptors: 4

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information