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(Q104913329)
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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
0 references
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
0 references
PubChem CID
10100278
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
AJPXZTKPPINUKN-UHFFFAOYSA-N
UniChem compound ID
32013665
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0033749
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
AJPXZTKPPINUKN-UHFFFAOYSA-N
Probes And Drugs ID
PD098640
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