Dehydroisocorydione

AlkaPlorer ID: AK055449

Synonym: '', 'Egenine', 'Humosine A', '(+)-Corytensine'

IUPAC Name: (6R,8R)-6-[(5S)-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-6,8-dihydrofuro[3,4-g][1,3]benzodioxol-8-ol

Structure

SMILES: CN1CCC2=CC3=C(C=C2[C@H]1[C@@H]1O[C@@H](O)C2=C4OCOC4=CC=C21)OCO3

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InChI: InChI=1S/C20H19NO6/c1-21-5-4-10-6-14-15(25-8-24-14)7-12(10)17(21)18-11-2-3-13-19(26-9-23-13)16(11)20(22)27-18/h2-3,6-7,17-18,20,22H,4-5,8-9H2,1H3/t17-,18+,20+/m0/s1

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InChIKey: YMHFBUOKLSWOQF-NLWGTHIKSA-N

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Source

Properties Information

Molecule Weight: 369.37300000000016

TPSA: 69.62000000000002

MolLogP: 2.4354000000000005

Number of H-Donors: 1

Number of H-Acceptors: 7

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information