(Q104394456)

English

2'-[4-[(7-hydroxy-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]phenoxy]-10,11-dimethoxy-5-methylspiro[5-azatricyclo[6.3.1.04,12]dodeca-1(12),8,10-triene-2,4'-cyclohexa-2,5-diene]-1'-one

group of stereoisomers with the chemical formula C₃₇H₄₀N₂O₆

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Statements

instance of

group of stereoisomers

0 references

subclass of

isoquinoline alkaloid

1 reference

inferred from

isoquinoline alkaloid

proaporphine alkaloid

1 reference

inferred from

proaporphine alkaloid

mass

608.2886370000001 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₇H₄₀N₂O₆

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canonical SMILES

O=C1C=CC2(C=C1OC3=CC=C(C=C3)CC4C5=CC(O)=C(OC)C=C5CCN4C)C=6C(OC)=C(OC)C=C7C6C(N(C)CC7)C2

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found in taxon

Berberis actinacantha

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stated in

The Stereochemistry at C-13 for the Proaporphine-benzylisoquinoline Alkaloids

Berberis boliviana

1 reference

stated in

Alkaloidal Content of Four Berberis Species. Structure of Berberilaurine, a New Bisbenzyltetrahydroisoquinoline

Identifiers

InChI

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

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InChIKey

KJCQZBUNNXWJCE-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

KJCQZBUNNXWJCE-UHFFFAOYSA-N

(Q104394456)

2'-[4-[(7-hydroxy-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]phenoxy]-10,11-dimethoxy-5-methylspiro[5-azatricyclo[6.3.1.04,12]dodeca-1(12),8,10-triene-2,4'-cyclohexa-2,5-diene]-1'-one

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Identifiers

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