U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C17H19NO3
Molecular Weight 285.3377
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of COCLAURINE

SMILES

COC1=CC2=C(C=C1O)[C@H](CC3=CC=C(O)C=C3)NCC2

InChI

InChIKey=LVVKXRQZSRUVPY-HNNXBMFYSA-N
InChI=1S/C17H19NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3/t15-/m0/s1

HIDE SMILES / InChI

Molecular Formula C17H19NO3
Molecular Weight 285.3377
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:41:20 GMT 2023
Edited
by admin
on Fri Dec 15 19:41:20 GMT 2023
Record UNII
CW1576313Y
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
COCLAURINE
MI  
Common Name English
MACHILINE
Common Name English
COCLAURINE [MI]
Common Name English
(1S)-1,2,3,4-TETRAHYDRO-1-((4-HYDROXYPHENYL)METHYL)-6-METHOXY-7-ISOQUINOLINOL
Systematic Name English
Code System Code Type Description
MESH
C004690
Created by admin on Fri Dec 15 19:41:20 GMT 2023 , Edited by admin on Fri Dec 15 19:41:20 GMT 2023
PRIMARY
CHEBI
58481
Created by admin on Fri Dec 15 19:41:20 GMT 2023 , Edited by admin on Fri Dec 15 19:41:20 GMT 2023
PRIMARY
CHEBI
27482
Created by admin on Fri Dec 15 19:41:20 GMT 2023 , Edited by admin on Fri Dec 15 19:41:20 GMT 2023
PRIMARY
PUBCHEM
160487
Created by admin on Fri Dec 15 19:41:20 GMT 2023 , Edited by admin on Fri Dec 15 19:41:20 GMT 2023
PRIMARY
CHEBI
15950
Created by admin on Fri Dec 15 19:41:20 GMT 2023 , Edited by admin on Fri Dec 15 19:41:20 GMT 2023
PRIMARY
WIKIPEDIA
Coclaurine
Created by admin on Fri Dec 15 19:41:20 GMT 2023 , Edited by admin on Fri Dec 15 19:41:20 GMT 2023
PRIMARY
MERCK INDEX
m3714
Created by admin on Fri Dec 15 19:41:20 GMT 2023 , Edited by admin on Fri Dec 15 19:41:20 GMT 2023
PRIMARY Merck Index
CHEBI
18417
Created by admin on Fri Dec 15 19:41:20 GMT 2023 , Edited by admin on Fri Dec 15 19:41:20 GMT 2023
PRIMARY
FDA UNII
CW1576313Y
Created by admin on Fri Dec 15 19:41:20 GMT 2023 , Edited by admin on Fri Dec 15 19:41:20 GMT 2023
PRIMARY
CAS
486-39-5
Created by admin on Fri Dec 15 19:41:20 GMT 2023 , Edited by admin on Fri Dec 15 19:41:20 GMT 2023
PRIMARY
EPA CompTox
DTXSID60197561
Created by admin on Fri Dec 15 19:41:20 GMT 2023 , Edited by admin on Fri Dec 15 19:41:20 GMT 2023
PRIMARY