(Q115950985)

English

(1R,3S)-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

chemical compound

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instance of

type of chemical entity

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subclass of

5-[1,1'-dihydroxy-4'-(6-hydroxy-8-methoxy-1,3-dimethyl-3,4-dihydroisoquinolin-7-yl)-8,8'-dimethoxy-6,6'-dimethyl-[2,2'-binaphthalen]-4-yl]-1,3-dimethyl-1,2,3,4-tetrahydroisoquinoline-6,8-diol

1 reference

based on heuristic

inferred from SMILES

mass

768.341066496 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₄₇H₄₈N₂O₈

0 references

canonical SMILES

OC=1C=C(O)C2=C(C1C3=CC(=C(O)C=4C(OC)=CC(=CC34)C)C=5C=C(C=6C=C(C=C(OC)C6C5O)C)C=7C(O)=CC8=C(C7OC)C(=NC(C)C8)C)CC(NC2C)C

0 references

isomeric SMILES

COc1c2c(cc(O)c1-c1cc(-c3cc(-c4c(O)cc(O)c5c4C[C@H](C)N[C@@H]5C)c4cc(C)cc(OC)c4c3O)c(O)c3c(OC)cc(C)cc13)C[C@@H](C)N=C2C

0 references

found in taxon

Ancistrocladus korupensis

1 reference

stated in

Korundamine A, a novel HIV-inhibitory and antimalarial "hybrid" naphthylisoquinoline alkaloid heterodimer from Ancistrocladus korupensis

Identifiers

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

0 references

InChIKey

NYSXYPCUWVSERK-GIFXNVAJSA-N

0 references

2 references

2 January 2023

inferred from InChIKey

matched by identifier from

InChIKey

NYSXYPCUWVSERK-GIFXNVAJSA-N

(Q115950985)

(1R,3S)-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

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Identifiers

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