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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H21NO4
Molecular Weight 303.3536
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of P-DEMETHYL DENOPAMINE

SMILES

COc1cc(ccc1O)CCNC[C@@]([H])(c2ccc(cc2)O)O

InChI

InChIKey=ANTJHPZSMSKEBL-INIZCTEOSA-N
InChI=1S/C17H21NO4/c1-22-17-10-12(2-7-15(17)20)8-9-18-11-16(21)13-3-5-14(19)6-4-13/h2-7,10,16,18-21H,8-9,11H2,1H3/t16-/m0/s1

HIDE SMILES / InChI

Molecular Formula C17H21NO4
Molecular Weight 303.3536
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 Sat Jun 26 16:18:21 UTC 2021
Edited
by admin
on Sat Jun 26 16:18:21 UTC 2021
Record UNII
J7MEK79MKW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
P-DEMETHYL DENOPAMINE
Common Name English
BENZENEMETHANOL, 4-HYDROXY-.ALPHA.-(((2-(4-HYDROXY-3-METHOXYPHENYL)ETHYL)AMINO)METHYL)-, (R)-
Systematic Name English
TA-064 METABOLITE M-1
Common Name English
Code System Code Type Description
CAS
87081-63-8
Created by admin on Sat Jun 26 16:18:22 UTC 2021 , Edited by admin on Sat Jun 26 16:18:22 UTC 2021
PRIMARY
PUBCHEM
24834639
Created by admin on Sat Jun 26 16:18:22 UTC 2021 , Edited by admin on Sat Jun 26 16:18:22 UTC 2021
PRIMARY
FDA UNII
J7MEK79MKW
Created by admin on Sat Jun 26 16:18:22 UTC 2021 , Edited by admin on Sat Jun 26 16:18:22 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
MAJOR
URINE