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

Details

Stereochemistry ABSOLUTE
Molecular Formula C17H17NO2
Molecular Weight 267.3224
Optical Activity ( + )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIHYDREXIDINE, (+)-

SMILES

[H][C@@]12CCC3=C(C=C(O)C(O)=C3)[C@@]1([H])C4=C(CN2)C=CC=C4

InChI

InChIKey=BGOQGUHWXBGXJW-RHSMWYFYSA-N
InChI=1S/C17H17NO2/c19-15-7-10-5-6-14-17(13(10)8-16(15)20)12-4-2-1-3-11(12)9-18-14/h1-4,7-8,14,17-20H,5-6,9H2/t14-,17-/m1/s1

HIDE SMILES / InChI

Molecular Formula C17H17NO2
Molecular Weight 267.3224
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:46:43 GMT 2023
Edited
by admin
on Sat Dec 16 14:46:43 GMT 2023
Record UNII
Q3PJ4B4D0X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIHYDREXIDINE, (+)-
Common Name English
BENZO(A)PHENANTHRIDINE-10,11-DIOL, 5,6,6A,7,8,12B-HEXAHYDRO-, (6AR,12BS)-
Systematic Name English
BENZO(A)PHENANTHRIDINE-10,11-DIOL, 5,6,6A,7,8,12B-HEXAHYDRO-, (6AR-TRANS)-
Systematic Name English
(6AR,12BS)-5,6,6A,7,8,12B-HEXAHYDROBENZO(A)PHENANTHRIDINE-10,11-DIOL
Common Name English
(+)-DIHYDREXIDINE
Common Name English
Code System Code Type Description
FDA UNII
Q3PJ4B4D0X
Created by admin on Sat Dec 16 14:46:43 GMT 2023 , Edited by admin on Sat Dec 16 14:46:43 GMT 2023
PRIMARY
PUBCHEM
6603820
Created by admin on Sat Dec 16 14:46:43 GMT 2023 , Edited by admin on Sat Dec 16 14:46:43 GMT 2023
PRIMARY
CAS
174691-84-0
Created by admin on Sat Dec 16 14:46:43 GMT 2023 , Edited by admin on Sat Dec 16 14:46:43 GMT 2023
PRIMARY
Related Record Type Details
PARENT->ACTIVE ISOMER
ENANTIOMER -> ENANTIOMER
RACEMATE -> ENANTIOMER