1,5,6,7-Isoquinolinetetrol; NH-form, 3,4-Dihydro, tri-Me ether, N-Me 

AlkaPlorer ID: AK201178

Synonym: 3,4-Dihydro-5,6,7-trimethoxy-2-methyl-1(2H)-isoquinolinone, N-Methylthalidaldine 

IUPAC Name: 5,6,7-trimethoxy-2-methyl-3,4-dihydroisoquinolin-1-one

Structure

SMILES: COC1=CC2=C(CCN(C)C2=O)C(OC)=C1OC

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InChI: InChI=1S/C13H17NO4/c1-14-6-5-8-9(13(14)15)7-10(16-2)12(18-4)11(8)17-3/h7H,5-6H2,1-4H3

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InChIKey: KBMHMJUDNKXZBG-UHFFFAOYSA-N

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Reference

Thalictrum alkaloids—VII

PubChem CID: 162931699

LOTUS: LTS0275623

SuperNatural Ⅲ: SN0181075

COCONUT: CNP0201716

Source

Properties Information

Molecule Weight: 251.282

TPSA: 48.0

MolLogP: 1.3405

Number of H-Donors: 0

Number of H-Acceptors: 4

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information