Secondary metabolite: Alpha-humulene



Alpha-humulene
Summary
Molecular formula: C15H24
SMILES: C/C/1=CCC(C)(C)/C=C/C/C(=C/CC1)/C
InChI: 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+
InChIKey: FAMPSKZZVDUYOS-HRGUGZIWSA-N
Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1=CCCC=CCCC=CC1

Scaffold Graph/Node level:
C1CCCCCCCCCC1

Scaffold Graph level:
C1CCCCCCCCCC1
Chemical classification
Kingdom: Organic compounds
Super class: Lipids and lipid-like molecules
Class: Prenol lipids
Sub class: Sesquiterpenoids
Synonymous chemical names:
alpha-humulene
External chemical identifiers:
CID_5281520; CAS_6753-98-6; CHEMSPIDER_4444853; ZINC_ZINC000030726967; Molport_MolPort-003-936-163
Chemical structure download

Designed by R.P. Vivek-Ananth, M Karthikeyan and Ajaya Kumar Sahoo