Ancistrobrevine A; 1-Epimer, 4',6-di-O-de-Me 

AlkaPlorer ID: AK287871

Synonym: Ancistrogriffine A

IUPAC Name: 7-(5-hydroxy-4-methoxy-7-methylnaphthalen-1-yl)-8-methoxy-1,2,3-trimethyl-3,4-dihydro-1H-isoquinolin-6-ol

Structure

SMILES: COC1=C2C(=CC(O)=C1C1=CC=C(OC)C3=C(O)C=C(C)C=C13)CC(C)N(C)C2C

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InChI: InChI=1S/C25H29NO4/c1-13-9-18-17(7-8-21(29-5)23(18)19(27)10-13)24-20(28)12-16-11-14(2)26(4)15(3)22(16)25(24)30-6/h7-10,12,14-15,27-28H,11H2,1-6H3

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InChIKey: UGEJDUMBFTVARC-UHFFFAOYSA-N

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Reference

PubChem CID: 22297395

CAS: 478796-14-4

COCONUT: CNP0316482.2

Properties Information

Molecule Weight: 407.51000000000016

TPSA: 62.16

MolLogP: 5.181020000000005

Number of H-Donors: 2

Number of H-Acceptors: 5

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information