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

Details

Stereochemistry ABSOLUTE
Molecular Formula C15H20O
Molecular Weight 216.3187
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DEHYDRONOOTKATONE

SMILES

C[C@@H]1CC(=O)C=C2C=C[C@H](C[C@@]12C)C(C)=C

InChI

InChIKey=PHRADXUJOZKVDN-JMSVASOKSA-N
InChI=1S/C15H20O/c1-10(2)12-5-6-13-8-14(16)7-11(3)15(13,4)9-12/h5-6,8,11-12H,1,7,9H2,2-4H3/t11-,12-,15+/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H20O
Molecular Weight 216.3187
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 18:18:50 GMT 2023
Edited
by admin
on Fri Dec 15 18:18:50 GMT 2023
Record UNII
T1450990SD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DEHYDRONOOTKATONE
FHFI  
Common Name English
2(3H)-NAPHTHALENONE, 4,4A,5,6-TETRAHYDRO-4,4A-DIMETHYL-6-(1-METHYLETHENYL)-, (4R-(4.ALPHA.,4A.ALPHA.,6.BETA.))-
Common Name English
4.BETA.H,5.ALPHA.-EREMOPHILA-1(10),8,11-TRIEN-2-ONE
Common Name English
2(3H)-NAPHTHALENONE, 4,4A,5,6-TETRAHYDRO-4,4A-DIMETHYL-6-(1-METHYLETHENYL)-, (4R,4AS,6S)-
Common Name English
DEHYDRONOOTKATONE [FHFI]
Common Name English
FEMA NO. 4091
Code English
8,9-DIDEHYDRONOOTKATONE
Common Name English
Code System Code Type Description
JECFA MONOGRAPH
1840
Created by admin on Fri Dec 15 18:18:50 GMT 2023 , Edited by admin on Fri Dec 15 18:18:50 GMT 2023
PRIMARY
CAS
5090-63-1
Created by admin on Fri Dec 15 18:18:50 GMT 2023 , Edited by admin on Fri Dec 15 18:18:50 GMT 2023
PRIMARY
FDA UNII
T1450990SD
Created by admin on Fri Dec 15 18:18:50 GMT 2023 , Edited by admin on Fri Dec 15 18:18:50 GMT 2023
PRIMARY
EPA CompTox
DTXSID60198932
Created by admin on Fri Dec 15 18:18:50 GMT 2023 , Edited by admin on Fri Dec 15 18:18:50 GMT 2023
PRIMARY
PUBCHEM
71586808
Created by admin on Fri Dec 15 18:18:50 GMT 2023 , Edited by admin on Fri Dec 15 18:18:50 GMT 2023
PRIMARY