Kopsirachine

AlkaPlorer ID: AK303759

Synonym: 2-(3,4-Dihydroxyphenyl)-3,4-dihydro-6,8-bis(octahydro-2,4,7-trimethyl-1H-2-pyridin-1-yl)-2H-1-benzopyran-3,5,7-triol 

IUPAC Name: 2-(3,4-dihydroxyphenyl)-6,8-bis(2,4,7-trimethyl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyridin-1-yl)-3,4-dihydro-2H-chromene-3,5,7-triol

Structure

SMILES: CC1CN(C)C(C2=C(O)C3=C(OC(C4=CC=C(O)C(O)=C4)C(O)C3)C(C3C4C(C)CCC4C(C)CN3C)=C2O)C2C(C)CCC12

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InChI: InChI=1S/C37H52N2O6/c1-17-7-10-22-19(3)15-38(5)32(28(17)22)30-34(43)24-14-27(42)36(21-9-12-25(40)26(41)13-21)45-37(24)31(35(30)44)33-29-18(2)8-11-23(29)20(4)16-39(33)6/h9,12-13,17-20,22-23,27-29,32-33,36,40-44H,7-8,10-11,14-16H2,1-6H3

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InChIKey: DSKQOOJRLGQDOK-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 620.8310000000002

TPSA: 116.86

MolLogP: 6.115900000000008

Number of H-Donors: 5

Number of H-Acceptors: 8

RingCount: 7

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information