(Q72487417)

English

Liensinine

chemical compound

4-[[(1R)-6,7-Dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-[[(1R)-1-[(4-hydroxyphenyl)methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]phenol

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Statements

instance of

type of chemical entity

0 references

subclass of

4-[(6,7-Dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]-2-({1-[(4-hydroxyphenyl)methyl]-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-yl}oxy)phenol

1 reference

based on heuristic

inferred from SMILES

mass

610.304287064 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₇H₄₂N₂O₆

0 references

canonical SMILES

OC1=CC=C(C=C1)CC2C3=CC(OC4=CC(=CC=C4O)CC5C6=CC(OC)=C(OC)C=C6CCN5C)=C(OC)C=C3CCN2C

0 references

isomeric SMILES

CN1CCC2=CC(=C(C=C2[C@H]1CC3=CC=C(C=C3)O)OC4=C(C=CC(=C4)C[C@@H]5C6=CC(=C(C=C6CCN5C)OC)OC)O)OC

0 references

found in taxon

Nelumbo nucifera

6 references

stated in

Effects of extracts and neferine from the embryo of Nelumbo nucifera seeds on the central nervous system

stated in

Alkaloids from Embryo of the Seed of Nelumbo Nucifera

stated in

Antioxidant activity of Nelumbo nucifera (sacred lotus) seeds

stated in

On the Alkaloids of Nelumbo nucifera GAERTN. X

stated in

On the Alkaloids of Nelumbo nucifera GAERTN. XII : Alkaloids of Loti Embryo. (5)

stated in

Bisbenzylisoquinoline Alkaloids from Nelumbo nucifera

physically interacts with

taste receptor type 2

subject has role

agonist

1 reference

stated in

Bitter substances from plants used in traditional Chinese medicine exert biased activation of human bitter taste receptors

Identifiers

InChI

InChI=1S/C37H42N2O6/c1-38-14-13-26-20-35(43-4)37(22-29(26)30(38)16-23-6-9-27(40)10-7-23)45-33-18-24(8-11-32(33)41)17-31-28-21-36(44-5)34(42-3)19-25(28)12-15-39(31)2/h6-11,18-22,30-31,40-41H,12-17H2,1-5H3/t30-,31-/m1/s1

0 references

InChIKey

XCUCMLUTCAKSOZ-FIRIVFDPSA-N

0 references

CAS Registry Number

2586-96-1

1 reference

InChIKey

XCUCMLUTCAKSOZ-FIRIVFDPSA-N

9 April 2021

https://commonchemistry.cas.org/detail?cas_rn=2586-96-1

PubChem CID

160644

1 reference

matched by identifier from

InChIKey

XCUCMLUTCAKSOZ-FIRIVFDPSA-N

ChEBI ID

186021

mapping relation type

exact match

2 references

stated in

ChEBI release 2022-06-13

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C37H42N2O6/c1-38-14-13-26-20-35(43-4)37(22-29(26)30(38)16-23-6-9-27(40)10-7-23)45-33-18-24(8-11-32(33)41)17-31-28-21-36(44-5)34(42-3)19-25(28)12-15-39(31)2/h6-11,18-22,30-31,40-41H,12-17H2,1-5H3/t30-,31-/m1/s1

1 reference

1 reference

matched by identifier from

InChIKey

XCUCMLUTCAKSOZ-FIRIVFDPSA-N

DSSTOX compound identifier

DTXCID601376969

0 references

EC number

683-151-0

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.208.665

retrieved

29 December 2019

title

[No public or meaningful name is available] (English)

quotation

CAS no.: 2586-96-1 (English)

ECHA Substance Infocard ID

100.208.665

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.208.665

retrieved

29 December 2019

title

[No public or meaningful name is available] (English)

quotation

CAS no.: 2586-96-1 (English)

Probes And Drugs ID

PD088043

0 references

(Q72487417)

Liensinine

Statements

Identifiers

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