(Q104913329)

English

1-{[4-Hydroxy-3-({6-methoxy-1-[(4-methoxyphenyl)methyl]-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-yl}oxy)phenyl]methyl}-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol

group of stereoisomers with the chemical formula C₃₇H₄₂N₂O₆

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Statements

instance of

group of stereoisomers

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subclass of

isoquinoline alkaloid

1 reference

inferred from

isoquinoline alkaloid

mass

610.3042870640002 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₇H₄₂N₂O₆

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canonical SMILES

OC1=CC=C(C=C1OC=2C=C3C(=CC2OC)CCN(C)C3CC4=CC=C(OC)C=C4)CC5C6=CC(O)=C(OC)C=C6CCN5C

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Identifiers

InChI

InChI=1S/C37H42N2O6/c1-38-15-13-26-20-36(44-5)37(22-29(26)30(38)16-23-6-9-27(42-3)10-7-23)45-35-18-24(8-11-32(35)40)17-31-28-21-33(41)34(43-4)19-25(28)12-14-39(31)2/h6-11,18-22,30-31,40-41H,12-17H2,1-5H3

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InChIKey

AJPXZTKPPINUKN-UHFFFAOYSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

AJPXZTKPPINUKN-UHFFFAOYSA-N

1 reference

Human Metabolome Database ID

HMDB0033749

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

AJPXZTKPPINUKN-UHFFFAOYSA-N

Probes And Drugs ID

PD098640

0 references

(Q104913329)

1-{[4-Hydroxy-3-({6-methoxy-1-[(4-methoxyphenyl)methyl]-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-yl}oxy)phenyl]methyl}-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol

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Identifiers

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