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

Details

Stereochemistry ABSOLUTE
Molecular Formula C17H19NO4.ClH
Molecular Weight 337.798
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BUPHANAMINE HYDROCHLORIDE

SMILES

Cl.COC1=C2OCOC2=CC3=C1C[N@@]4CC[C@@]35[C@H]4CC=C[C@H]5O

InChI

InChIKey=ZAGPZIHOUNHAQG-ACKNSJPISA-N
InChI=1S/C17H19NO4.ClH/c1-20-15-10-8-18-6-5-17(13(18)3-2-4-14(17)19)11(10)7-12-16(15)22-9-21-12;/h2,4,7,13-14,19H,3,5-6,8-9H2,1H3;1H/t13-,14-,17+;/m1./s1

HIDE SMILES / InChI

Molecular Formula C17H19NO4
Molecular Weight 301.3371
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 23:24:15 GMT 2025
Edited
by admin
on Mon Mar 31 23:24:15 GMT 2025
Record UNII
39WL2KGI7K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BUPHANAMINE HYDROCHLORIDE [MI]
Preferred Name English
BUPHANAMINE HYDROCHLORIDE
MI  
Common Name English
1H,6H-5,11B-ETHANO(1,3)DIOXOLO(4,5-J)PHENANTHRIDIN-1-OL, 4,4A-DIHYDRO-7-METHOXY-, HYDROCHLORIDE, (1R,4AR,5S,11BS)-
Systematic Name English
Code System Code Type Description
PUBCHEM
76969696
Created by admin on Mon Mar 31 23:24:15 GMT 2025 , Edited by admin on Mon Mar 31 23:24:15 GMT 2025
PRIMARY
FDA UNII
39WL2KGI7K
Created by admin on Mon Mar 31 23:24:15 GMT 2025 , Edited by admin on Mon Mar 31 23:24:15 GMT 2025
PRIMARY
MERCK INDEX
m2766
Created by admin on Mon Mar 31 23:24:15 GMT 2025 , Edited by admin on Mon Mar 31 23:24:15 GMT 2025
PRIMARY Merck Index