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

Details

Stereochemistry ABSOLUTE
Molecular Formula C15H24
Molecular Weight 204.3511
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of THUJOPSENE

SMILES

CC1=CC[C@]2(C)CCCC(C)(C)[C@@]23C[C@@H]13

InChI

InChIKey=WXQGPFZDVCRBME-QEJZJMRPSA-N
InChI=1S/C15H24/c1-11-6-9-14(4)8-5-7-13(2,3)15(14)10-12(11)15/h6,12H,5,7-10H2,1-4H3/t12-,14-,15-/m0/s1

HIDE SMILES / InChI

Molecular Formula C15H24
Molecular Weight 204.3511
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:57:54 GMT 2023
Edited
by admin
on Sat Dec 16 08:57:54 GMT 2023
Record UNII
E116U47P7N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
THUJOPSENE
MI  
Common Name English
SESQUICHAMENE
Common Name English
CYCLOPROPA(D)NAPHTHALENE, 1,1A,4,4A,5,6,7,8-OCTAHYDRO-2,4A,8,8-TETRAMETHYL-, (1AS-(1A.ALPHA.,4A.BETA.,8AR*))-
Systematic Name English
THUJOPSENE [MI]
Common Name English
(-)-THUJOPSENE
Common Name English
CYCLOPROPA(D)NAPHTHALENE, 1,1A,4,4A,5,6,7,8-OCTAHYDRO-2,4A,8,8-TETRAMETHYL-, (1AS,4AS,8AS)-
Systematic Name English
WIDDRENE
Common Name English
THUJOPSEN
Common Name English
CIS-(-)-THUJOPSENE
Common Name English
THUJOPSENE, (-)-
Common Name English
NSC-44707
Code English
Code System Code Type Description
CAS
470-40-6
Created by admin on Sat Dec 16 08:57:54 GMT 2023 , Edited by admin on Sat Dec 16 08:57:54 GMT 2023
PRIMARY
WIKIPEDIA
Thujopsene
Created by admin on Sat Dec 16 08:57:54 GMT 2023 , Edited by admin on Sat Dec 16 08:57:54 GMT 2023
PRIMARY
MERCK INDEX
m10817
Created by admin on Sat Dec 16 08:57:54 GMT 2023 , Edited by admin on Sat Dec 16 08:57:54 GMT 2023
PRIMARY Merck Index
FDA UNII
E116U47P7N
Created by admin on Sat Dec 16 08:57:54 GMT 2023 , Edited by admin on Sat Dec 16 08:57:54 GMT 2023
PRIMARY
ECHA (EC/EINECS)
207-426-8
Created by admin on Sat Dec 16 08:57:54 GMT 2023 , Edited by admin on Sat Dec 16 08:57:54 GMT 2023
PRIMARY
CHEBI
9578
Created by admin on Sat Dec 16 08:57:54 GMT 2023 , Edited by admin on Sat Dec 16 08:57:54 GMT 2023
PRIMARY
EPA CompTox
DTXSID50881245
Created by admin on Sat Dec 16 08:57:54 GMT 2023 , Edited by admin on Sat Dec 16 08:57:54 GMT 2023
PRIMARY
NSC
44707
Created by admin on Sat Dec 16 08:57:54 GMT 2023 , Edited by admin on Sat Dec 16 08:57:54 GMT 2023
PRIMARY
PUBCHEM
442402
Created by admin on Sat Dec 16 08:57:54 GMT 2023 , Edited by admin on Sat Dec 16 08:57:54 GMT 2023
PRIMARY