Deacetyllycoclavine; 5-O-[3-(3-Hydroxy-4-methoxyphenyl)propanoyl] 

AlkaPlorer ID: AK294506

Synonym: Fargesiine B

IUPAC Name: None

Structure

SMILES: COC1=CC=C(CCC(=O)OC2C(O)C3CC(C)CC45C3CCCN4CCCC25)C=C1O

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InChI: InChI=1S/C26H37NO5/c1-16-13-18-19-5-3-11-27-12-4-6-20(26(19,27)15-16)25(24(18)30)32-23(29)10-8-17-7-9-22(31-2)21(28)14-17/h7,9,14,16,18-20,24-25,28,30H,3-6,8,10-13,15H2,1-2H3

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InChIKey: UBEYTSVZBWBYGS-UHFFFAOYSA-N

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Reference

CAS: 1902161-52-7

Properties Information

Molecule Weight: 443.58400000000034

TPSA: 79.23

MolLogP: 3.5266000000000024

Number of H-Donors: 2

Number of H-Acceptors: 6

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information