(Q105292155)

English

(1S,3S)-5-[4-hydroxy-3-[1-hydroxy-4-[(3R)-6-hydroxy-8-methoxy-1,3-dimethyl-3,4-dihydroisoquinolin-5-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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Statements

instance of

type of chemical entity

0 references

subclass of

isoquinoline alkaloid

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mass

768.341066496 dalton

1 reference

1 reference

C₄₇H₄₈N₂O₈

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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)C7=C(O)C=C(OC)C=8C(=NC(C)CC78)C)CC(NC2C)C

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isomeric SMILES

COc1cc(O)c(-c2cc(-c3cc(-c4c(O)cc(O)c5c4C[C@H](C)N[C@H]5C)c4cc(C)cc(OC)c4c3O)c(O)c3c(OC)cc(C)cc23)c2c1C(C)=N[C@H](C)C2

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found in taxon

Ancistrocladus korupensis

1 reference

stated in

Yaoundamines A and B, new antimalarial naphthylisoquinoline alkaloids from Ancistrocladus korupensis

Identifiers

InChI

InChI=1S/C47H48N2O8/c1-20-10-26-28(42-32-14-22(3)48-24(5)40(32)34(50)18-35(42)51)16-30(46(53)44(26)37(12-20)55-7)31-17-29(27-11-21(2)13-38(56-8)45(27)47(31)54)43-33-15-23(4)49-25(6)41(33)39(57-9)19-36(43)52/h10-13,16-19,22-24,48,50-54H,14-15H2,1-9H3/t22-,23+,24-/m0/s1

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InChIKey

VSDWMCJBOALEDE-VXNXHJTFSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VSDWMCJBOALEDE-VXNXHJTFSA-N

(Q105292155)

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

Statements

Identifiers

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