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

Details

Stereochemistry ACHIRAL
Molecular Formula C20H19NO
Molecular Weight 289.371
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DESMETHYLCYPROHEPTADINE 10,11-EPOXIDE

SMILES

C1CC(CCN1)=C2C3=C(C=CC=C3)C4OC4C5=C2C=CC=C5

InChI

InChIKey=LQCXYBFJXNJNQQ-UHFFFAOYSA-N
InChI=1S/C20H19NO/c1-3-7-16-14(5-1)18(13-9-11-21-12-10-13)15-6-2-4-8-17(15)20-19(16)22-20/h1-8,19-21H,9-12H2

HIDE SMILES / InChI

Molecular Formula C20H19NO
Molecular Weight 289.371
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:01:34 UTC 2023
Edited
by admin
on Sat Dec 16 08:01:34 UTC 2023
Record UNII
V7JNC2PZ2C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DESMETHYLCYPROHEPTADINE 10,11-EPOXIDE
Common Name English
DESMETHYLCYPROHEPTADINE EPOXIDE
Common Name English
N-DEMETHYLCYPROHEPTADINE 10,11-EPOXIDE
Common Name English
DEMETHYLCYPROHEPTADINE 10,11-EPOXIDE
Common Name English
Code System Code Type Description
CAS
54191-03-6
Created by admin on Sat Dec 16 08:01:34 UTC 2023 , Edited by admin on Sat Dec 16 08:01:34 UTC 2023
PRIMARY
PUBCHEM
124167
Created by admin on Sat Dec 16 08:01:34 UTC 2023 , Edited by admin on Sat Dec 16 08:01:34 UTC 2023
PRIMARY
FDA UNII
V7JNC2PZ2C
Created by admin on Sat Dec 16 08:01:34 UTC 2023 , Edited by admin on Sat Dec 16 08:01:34 UTC 2023
PRIMARY
EPA CompTox
DTXSID50969153
Created by admin on Sat Dec 16 08:01:34 UTC 2023 , Edited by admin on Sat Dec 16 08:01:34 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE