(-)-Acetylsukhodianine

AlkaPlorer ID: AK188708

Synonym: '(-)-O-Acetylsukhodianine'

IUPAC Name: [(12R,13S)-15,16-dimethoxy-11-methyl-3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1(20),2(6),7,14(19),15,17-hexaen-13-yl] acetate

Structure

SMILES: COC1=CC=C2C3=C4OCOC4=CC4=C3[C@H]([C@@H](OC(C)=O)C2=C1OC)N(C)CC4

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InChI: InChI=1S/C22H23NO6/c1-11(24)29-22-18-13(5-6-14(25-3)20(18)26-4)17-16-12(7-8-23(2)19(16)22)9-15-21(17)28-10-27-15/h5-6,9,19,22H,7-8,10H2,1-4H3/t19-,22+/m1/s1

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InChIKey: WPCZROVYBARYJT-KNQAVFIVSA-N

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Source

Properties Information

Molecule Weight: 397.4270000000002

TPSA: 66.46

MolLogP: 3.2463000000000024

Number of H-Donors: 0

Number of H-Acceptors: 7

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information