Caulophylline E

AlkaPlorer ID: AK256957

Synonym: 2,3-Dihydro-5,7,8-trimethoxyindeno[1,2,3-ij]isoquinolin-6-ol 

IUPAC Name: 7,11,12-trimethoxy-2-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1,5,7,9(16),10(15),11,13-heptaen-8-ol

Structure

SMILES: COC1=CC2=C3C(=NCC2)C2=CC=C(OC)C(OC)=C2C3=C1O

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InChI: InChI=1S/C18H17NO4/c1-21-11-5-4-10-14(18(11)23-3)15-13-9(6-7-19-16(10)13)8-12(22-2)17(15)20/h4-5,8,20H,6-7H2,1-3H3

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InChIKey: UATZDQOOVUKMOG-UHFFFAOYSA-N

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Reference

PubChem CID: 162859188

COCONUT: CNP0122155

Source

Properties Information

Molecule Weight: 311.33700000000005

TPSA: 60.28

MolLogP: 2.7919000000000014

Number of H-Donors: 1

Number of H-Acceptors: 5

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information