(1R,3R)-5-(4-hydroxy-3-{1-hydroxy-4-[(3R)-6-hydroxy-8-methoxy-1,3-dimethyl-3,4-dihydroisoquinolin-7-yl]-8-methoxy-6-methylnaphthalen-2-yl}-5-methoxy-7-methylnaphthalen-1-yl)-1,3-dimethyl-1,2,3,4-tetrahydroisoquinoline-6,8-diol

AlkaPlorer ID: AK473756

Synonym: None

IUPAC Name: (3R)-5-[4-hydroxy-3-[1-hydroxy-4-[(3R)-6-hydroxy-8-methoxy-1,3-dimethyl-3,4-dihydroisoquinolin-7-yl]-8-methoxy-6-methylnaphthalen-2-yl]-5-methoxy-7-methylnaphthalen-1-yl]-1,3-dimethyl-1,2,3,4-tetrahydroisoquinoline-6,8-diol

Structure

SMILES: COC1=C2C(C)=N[C@H](C)CC2=CC(O)=C1C1=CC(C2=CC(C3=C(O)C=C(O)C4=C3C[C@@H](C)NC4C)=C3C=C(C)C=C(OC)C3=C2O)=C(O)C2=C(OC)C=C(C)C=C12

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InChI: InChI=1S/C47H48N2O8/c1-20-10-27-29(41-33-15-23(4)49-25(6)40(33)35(51)19-36(41)52)17-31(45(53)43(27)37(12-20)55-7)32-18-30(28-11-21(2)13-38(56-8)44(28)46(32)54)42-34(50)16-26-14-22(3)48-24(5)39(26)47(42)57-9/h10-13,16-19,22-23,25,49-54H,14-15H2,1-9H3/t22-,23-,25?/m1/s1

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InChIKey: NYSXYPCUWVSERK-PSJAQFSKSA-N

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Properties Information

Molecule Weight: 768.907

TPSA: 153.23

MolLogP: 9.513439999999996

Number of H-Donors: 6

Number of H-Acceptors: 10

RingCount: 8

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information