Herb Integrative Database

Traditional Medicine Data Platform

Ingredients

(r)-n-methylcoclaurine

C18H21NO3

View Knowledge Graph Back to List

Entity Type: Ingredients
Relation Groups: 2
Relation Preview: 16

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name: (r)-n-methylcoclaurine
Molecular Formula: C18H21NO3
Molecular Weight: No data
Canonical SMILES: CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)O)O)OC
Isomeric SMILES: CN1CCC2=CC(=C(C=C2[C@H]1CC3=CC=C(C=C3)O)O)OC
InChI: InChI=1S/C18H21NO3/c1-19-8-7-13-10-18(22-2)17(21)11-15(13)16(19)9-12-3-5-14(20)6-4-12/h3-6,10-11,16,20-21H,7-9H2,1-2H3/t16-/m1/s1
Oral Bioavailability: 3.348
Drug Likeness: 0.915
DL Score: No data
Caco-2 Permeability: No data
ALogP: No data
Bioavailability Score: No data

Identifiers

InChI Key: No data
PubChem CID: No data

Description and Extensions

Toxicity Information: No data

Related

Direct relations and traceable candidates grouped by relation type.

Source Herbs Active Targets

Source Herbs

herb ingredient8 Herbs

Graph More Herbs

01

Da Liang Jiang / Rhizoma Alpiniae Galangae

Da Liang JiangRhizoma Alpiniae Galangae

02

Da Cao Kou / Alpinia Zerumbet

Da Cao KouAlpinia Zerumbet

03

Song Xun / Tricholoma Matsutake

Song XunTricholoma Matsutake

04

Fu Ping / Spirodelae Herba; Herba Spirodelae

Fu PingSpirodelae Herba; Herba Spirodelae

05

Luo Le / Herba Ocimi Basilici

Luo LeHerba Ocimi Basilici

06

He Ye / Folium Nelumbinis; Nelumbinis Folium

He YeFolium Nelumbinis; Nelumbinis Folium

07

Heng Zhou Wu Yao / Cocculus Laurifolius

Heng Zhou Wu YaoCocculus Laurifolius

08

Gao Liang Jiang / Alpiniae Officinarum Rhizoma; Rhizoma Alpiniae Officinarum

Gao Liang JiangAlpiniae Officinarum Rhizoma; Rhizoma Alpiniae Officinarum