(Q104888300)

English

(6aR)-9-[4-[[(1S)-6-hydroxy-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]phenoxy]-1,2-dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-10-ol

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

9-[4-[(6-hydroxy-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]phenoxy]-1,2-dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-10-ol

1 reference

based on heuristic

inferred from SMILES

mass

608.288637 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₇H₄₀N₂O₆

0 references

canonical SMILES

OC=1C=C2C(=CC1OC3=CC=C(C=C3)CC4C5=CC(OC)=C(O)C=C5CCN4C)CC6C=7C(=CC(OC)=C(OC)C27)CCN6C

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isomeric SMILES

COc1cc2c(cc1O)CCN(C)[C@H]2Cc1ccc(Oc2cc3c(cc2O)-c2c(OC)c(OC)cc4c2[C@@H](C3)N(C)CC4)cc1

0 references

found in taxon

Berberis calliobotrys

1 reference

stated in

An aporphine-benzylisoquinoline alkaloid from Berberis waziristanica

Identifiers

InChI

InChI=1S/C37H40N2O6/c1-38-12-10-22-16-30(40)32(42-3)20-26(22)28(38)14-21-6-8-25(9-7-21)45-33-18-24-15-29-35-23(11-13-39(29)2)17-34(43-4)37(44-5)36(35)27(24)19-31(33)41/h6-9,16-20,28-29,40-41H,10-15H2,1-5H3/t28-,29+/m0/s1

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InChIKey

XVIJZZUKMXFAJB-URLMMPGGSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q104888300)

(6aR)-9-[4-[[(1S)-6-hydroxy-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]phenoxy]-1,2-dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-10-ol

Statements

Identifiers

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