Thaliatrine

AlkaPlorer ID: AK315740

Synonym: None

IUPAC Name: 4-methoxy-6-[[4-[2-methoxy-5-[(4-methoxy-7-methyl-8,9-dihydro-6H-[1,3]dioxolo[4,5-f]isoquinolin-6-yl)methyl]phenoxy]phenyl]methyl]-7-methyl-8,9-dihydro-6H-[1,3]dioxolo[4,5-f]isoquinoline

Structure

SMILES: COC1=CC=C(CC2C3=C(CCN2C)C2=C(OCO2)C(OC)=C3)C=C1OC1=CC=C(CC2C3=C(CCN2C)C2=C(OCO2)C(OC)=C3)C=C1

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InChI: InChI=1S/C39H42N2O8/c1-40-14-12-26-28(19-34(43-4)38-36(26)45-21-47-38)30(40)16-23-6-9-25(10-7-23)49-33-18-24(8-11-32(33)42-3)17-31-29-20-35(44-5)39-37(46-22-48-39)27(29)13-15-41(31)2/h6-11,18-20,30-31H,12-17,21-22H2,1-5H3

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InChIKey: QCFHNGUCKUUHJI-UHFFFAOYSA-N

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Source

Properties Information

Molecule Weight: 666.7710000000002

TPSA: 80.32000000000001

MolLogP: 6.505500000000007

Number of H-Donors: 0

Number of H-Acceptors: 10

RingCount: 8

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information