Maclekarpine D

AlkaPlorer ID: AK304939

Synonym: None

IUPAC Name: 2-[(1,2-dimethoxy-12-methyl-13H-[1,3]benzodioxolo[5,6-c]phenanthridin-13-yl)-hydroxymethyl]oxane-2,3,4,5-tetrol

Structure

SMILES: COC1=CC=C2C3=CC=C4C=C5OCOC5=CC4=C3N(C)C(C(O)C3(O)OCC(O)C(O)C3O)C2=C1OC

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InChI: InChI=1S/C27H29NO10/c1-28-21-14(5-4-12-8-18-19(9-15(12)21)37-11-36-18)13-6-7-17(34-2)24(35-3)20(13)22(28)25(31)27(33)26(32)23(30)16(29)10-38-27/h4-9,16,22-23,25-26,29-33H,10-11H2,1-3H3

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InChIKey: BPRRWHFNRAGIDG-UHFFFAOYSA-N

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Source

Properties Information

Molecule Weight: 527.5260000000001

TPSA: 150.54

MolLogP: 0.9059999999999988

Number of H-Donors: 5

Number of H-Acceptors: 11

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information