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Details

Stereochemistry RACEMIC
Molecular Formula C15H22
Molecular Weight 202.3352
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CALAMENENE, CIS-(±)-

SMILES

CC(C)[C@@H]1CC[C@H](C)C2=CC=C(C)C=C12

InChI

InChIKey=PGTJIOWQJWHTJJ-STQMWFEESA-N
InChI=1S/C15H22/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5,7,9-10,12-13H,6,8H2,1-4H3/t12-,13-/m0/s1

HIDE SMILES / InChI

Molecular Formula C15H22
Molecular Weight 202.3352
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 14:17:27 GMT 2023
Edited
by admin
on Sat Dec 16 14:17:27 GMT 2023
Record UNII
5C6W67N6XM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CALAMENENE, CIS-(±)-
Common Name English
(±)-CADINA-1,3,5-TRIENE
Common Name English
NAPHTHALENE, 1,2,3,4-TETRAHYDRO-1,6-DIMETHYL-4-(1-METHYLETHYL)-, (1R,4R)-REL-
Systematic Name English
Code System Code Type Description
CAS
72937-55-4
Created by admin on Sat Dec 16 14:17:27 GMT 2023 , Edited by admin on Sat Dec 16 14:17:27 GMT 2023
PRIMARY
PUBCHEM
6429077
Created by admin on Sat Dec 16 14:17:27 GMT 2023 , Edited by admin on Sat Dec 16 14:17:27 GMT 2023
PRIMARY
EPA CompTox
DTXSID501042907
Created by admin on Sat Dec 16 14:17:27 GMT 2023 , Edited by admin on Sat Dec 16 14:17:27 GMT 2023
PRIMARY
FDA UNII
5C6W67N6XM
Created by admin on Sat Dec 16 14:17:27 GMT 2023 , Edited by admin on Sat Dec 16 14:17:27 GMT 2023
PRIMARY