Cornigerine; (S)-form 

AlkaPlorer ID: AK293004

Synonym: None

IUPAC Name: N-(5,19-dimethoxy-6-oxo-15,17-dioxatetracyclo[10.7.0.02,8.014,18]nonadeca-1(19),2,4,7,12,14(18)-hexaen-9-yl)acetamide

Structure

SMILES: COC1=C2C(=CC3=C1OCO3)CCC(N=C(C)O)C1=CC(=O)C(OC)=CC=C12

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InChI: InChI=1S/C21H21NO6/c1-11(23)22-15-6-4-12-8-18-20(28-10-27-18)21(26-3)19(12)13-5-7-17(25-2)16(24)9-14(13)15/h5,7-9,15H,4,6,10H2,1-3H3,(H,22,23)

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InChIKey: DCYAJVOKJAFSES-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 383.4000000000001

TPSA: 86.58

MolLogP: 3.4234000000000018

Number of H-Donors: 1

Number of H-Acceptors: 6

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information