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

Details

Stereochemistry ACHIRAL
Molecular Formula C15H24
Molecular Weight 204.3511
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HUMULENE

SMILES

C\C1=C/CC(C)(C)\C=C\C\C(C)=C\CC1

InChI

InChIKey=FAMPSKZZVDUYOS-HRGUGZIWSA-N
InChI=1S/C15H24/c1-13-7-5-8-14(2)10-12-15(3,4)11-6-9-13/h6-7,10-11H,5,8-9,12H2,1-4H3/b11-6+,13-7+,14-10+

HIDE SMILES / InChI

Molecular Formula C15H24
Molecular Weight 204.3511
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:05:13 UTC 2023
Edited
by admin
on Fri Dec 15 19:05:13 UTC 2023
Record UNII
54W56MD2WD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HUMULENE
MI  
Common Name English
HUMULENE, ALPHA-
Common Name English
1,4,8-CYCLOUNDECATRIENE, 2,6,6,9-TETRAMETHYL-, (1E,4E,8E)-
Systematic Name English
.ALPHA.-HUMULENE
Common Name English
(1E,4E,8E)-2,6,6,9-TETRAMETHYL-1,4,8-CYCLOUNDECATRIENE
Systematic Name English
.ALPHA.-CARYOPHYLLENE
Common Name English
HUMULENE [MI]
Common Name English
1,4,8-CYCLOUNDECATRIENE, 2,6,6,9-TETRAMETHYL-, (E,E,E)-
Systematic Name English
(±)-.ALPHA.-HUMULENE
Common Name English
Code System Code Type Description
MERCK INDEX
m6062
Created by admin on Fri Dec 15 19:05:13 UTC 2023 , Edited by admin on Fri Dec 15 19:05:13 UTC 2023
PRIMARY Merck Index
WIKIPEDIA
HUMULENE
Created by admin on Fri Dec 15 19:05:13 UTC 2023 , Edited by admin on Fri Dec 15 19:05:13 UTC 2023
PRIMARY
MESH
C042686
Created by admin on Fri Dec 15 19:05:13 UTC 2023 , Edited by admin on Fri Dec 15 19:05:13 UTC 2023
PRIMARY
RXCUI
2266811
Created by admin on Fri Dec 15 19:05:13 UTC 2023 , Edited by admin on Fri Dec 15 19:05:13 UTC 2023
PRIMARY
CHEBI
5768
Created by admin on Fri Dec 15 19:05:13 UTC 2023 , Edited by admin on Fri Dec 15 19:05:13 UTC 2023
PRIMARY
EPA CompTox
DTXSID30858793
Created by admin on Fri Dec 15 19:05:13 UTC 2023 , Edited by admin on Fri Dec 15 19:05:13 UTC 2023
PRIMARY
CAS
6753-98-6
Created by admin on Fri Dec 15 19:05:13 UTC 2023 , Edited by admin on Fri Dec 15 19:05:13 UTC 2023
PRIMARY
DAILYMED
54W56MD2WD
Created by admin on Fri Dec 15 19:05:13 UTC 2023 , Edited by admin on Fri Dec 15 19:05:13 UTC 2023
PRIMARY
FDA UNII
54W56MD2WD
Created by admin on Fri Dec 15 19:05:13 UTC 2023 , Edited by admin on Fri Dec 15 19:05:13 UTC 2023
PRIMARY
PUBCHEM
5281520
Created by admin on Fri Dec 15 19:05:13 UTC 2023 , Edited by admin on Fri Dec 15 19:05:13 UTC 2023
PRIMARY
ECHA (EC/EINECS)
229-816-7
Created by admin on Fri Dec 15 19:05:13 UTC 2023 , Edited by admin on Fri Dec 15 19:05:13 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT
Sesquiterpene Class