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

Details

Stereochemistry RACEMIC
Molecular Formula C16H25NO
Molecular Weight 247.3758
Optical Activity ( + / - )
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIHYDRO-.ALPHA.-PHP

SMILES

CCCCC(C(O)C1=CC=CC=C1)N2CCCC2

InChI

InChIKey=GJHNPZVIGWPXBH-UHFFFAOYSA-N
InChI=1S/C16H25NO/c1-2-3-11-15(17-12-7-8-13-17)16(18)14-9-5-4-6-10-14/h4-6,9-10,15-16,18H,2-3,7-8,11-13H2,1H3

HIDE SMILES / InChI

Molecular Formula C16H25NO
Molecular Weight 247.3758
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 18:53:58 GMT 2023
Edited
by admin
on Sat Dec 16 18:53:58 GMT 2023
Record UNII
ZM8F9BE72F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIHYDRO-.ALPHA.-PHP
Common Name English
.BETA.-BUTYL-.ALPHA.-PHENYL-1-PYRROLIDINEETHANOL
Systematic Name English
DIHYDRO-.ALPHA.-PYRROLIDINOHEXANOPHENONE
Systematic Name English
.ALPHA.-PYRROLIDINOHEXANOPHENONE METABOLITE
Systematic Name English
1-PYRROLIDINEETHANOL, .BETA.-BUTYL-.ALPHA.-PHENYL-
Systematic Name English
1-PHENYL-2-(PYRROLIDIN-1-YL)HEXAN-1-OL
Systematic Name English
BOH-PHP
Common Name English
BETA-HYDROXY-ALPHA-PYRROLIDINOHEXANOPHENONE
Systematic Name English
.BETA.-HYDROXY-.ALPHA.-PHP
Common Name English
Code System Code Type Description
CAS
1821459-78-2
Created by admin on Sat Dec 16 18:53:58 GMT 2023 , Edited by admin on Sat Dec 16 18:53:58 GMT 2023
PRIMARY
FDA UNII
ZM8F9BE72F
Created by admin on Sat Dec 16 18:53:58 GMT 2023 , Edited by admin on Sat Dec 16 18:53:58 GMT 2023
PRIMARY
PUBCHEM
102107924
Created by admin on Sat Dec 16 18:53:58 GMT 2023 , Edited by admin on Sat Dec 16 18:53:58 GMT 2023
PRIMARY
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SALT/SOLVATE -> PARENT
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ACTIVE MOIETY