Coccutrine

AlkaPlorer ID: AK108811

Synonym: ''

IUPAC Name: (2S,13bS)-2,10-dimethoxy-2,3,5,6,8,9-hexahydro-1H-indolo[7a,1-a]isoquinolin-12-ol

Structure

SMILES: COC1=CC(O)=CC2=C1CCN1CCC3=CC[C@H](OC)C[C@]321

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InChI: InChI=1S/C18H23NO3/c1-21-14-4-3-12-5-7-19-8-6-15-16(18(12,19)11-14)9-13(20)10-17(15)22-2/h3,9-10,14,20H,4-8,11H2,1-2H3/t14-,18-/m0/s1

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InChIKey: RDXIEGVPUDECJS-KSSFIOAISA-N

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Properties Information

Molecule Weight: 301.386

TPSA: 41.93000000000001

MolLogP: 2.5931000000000006

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information