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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H29NO5
Molecular Weight 387.4694
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5'-METHOXYLAUDANOSINE, (R)-

SMILES

COC1=CC2=C(C=C1OC)[C@@H](CC3=CC(OC)=C(OC)C(OC)=C3)N(C)CC2

InChI

InChIKey=ALQIPWOCCJXSKZ-QGZVFWFLSA-N
InChI=1S/C22H29NO5/c1-23-8-7-15-12-18(24-2)19(25-3)13-16(15)17(23)9-14-10-20(26-4)22(28-6)21(11-14)27-5/h10-13,17H,7-9H2,1-6H3/t17-/m1/s1

HIDE SMILES / InChI

Molecular Formula C22H29NO5
Molecular Weight 387.4694
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 Tue Apr 01 22:53:15 GMT 2025
Edited
by admin
on Tue Apr 01 22:53:15 GMT 2025
Record UNII
FL92A1ETG9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(R)-(-)-5'-METHOXYLAUDANOSINE
Preferred Name English
5'-METHOXYLAUDANOSINE, (R)-
Common Name English
(1R)-1,2,3,4-TETRAHYDRO-6,7-DIMETHOXY-2-METHYL-1-((3,4,5-TRIMETHOXYPHENYL)METHYL)-ISOQUINOLINE
Systematic Name English
ISOQUINOLINE, 1,2,3,4-TETRAHYDRO-6,7-DIMETHOXY-2-METHYL-1-((3,4,5-TRIMETHOXYPHENYL)METHYL)-, (1R)-
Systematic Name English
Code System Code Type Description
CAS
104758-49-8
Created by admin on Tue Apr 01 22:53:15 GMT 2025 , Edited by admin on Tue Apr 01 22:53:15 GMT 2025
PRIMARY
FDA UNII
FL92A1ETG9
Created by admin on Tue Apr 01 22:53:15 GMT 2025 , Edited by admin on Tue Apr 01 22:53:15 GMT 2025
PRIMARY
EPA CompTox
DTXSID101018100
Created by admin on Tue Apr 01 22:53:15 GMT 2025 , Edited by admin on Tue Apr 01 22:53:15 GMT 2025
PRIMARY
PUBCHEM
11132844
Created by admin on Tue Apr 01 22:53:15 GMT 2025 , Edited by admin on Tue Apr 01 22:53:15 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT