Results for:
PubChem ID: 90899

4-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl)but-3-en-2-one

Compound Details

Synonymous names	3-Buten-2-one, 4-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)- 3-Buten-2-one, 4-(2,2,6-trimethyl-7-oxabicyclo(4.1.0)hept-1-yl)- beta-ionone 5,6-epoxide EINECS 245-542-0 5,6-beta-Ionone epoxide DTXSID8051885 4-(1,2-Epoxy-2,6,6-trimethylcyclohexyl)-3-butenone-2 WLZ3135 ZTJZJYUGOJYHCU-UHFFFAOYSA-N DB-282879 NS00013296 Q27159719 4-(2,6,6-trimethyl-1,2-epoxycyclohexyl)-3-buten-2-one
Microorganism:	Yes
IUPAC name	4-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl)but-3-en-2-one
SMILES	CC(=O)C=CC12C(CCCC1(O2)C)(C)C
Inchi	InChI=1S/C13H20O2/c1-10(14)6-9-13-11(2,3)7-5-8-12(13,4)15-13/h6,9H,5,7-8H2,1-4H3
Formula	C13H20O2
PubChem ID	90899
Molweight	208.3
LogP	2
Atoms	15
Bonds	2
H-bond Acceptor	2
H-bond Donor	0
Chemical Classification	heterocyclic compounds epoxides ketones ethers terpenes
CHEBI-ID	87546
Supernatural-ID	SN0479774

mVOC Specific Details

Species emitting the compound

Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a NA Dickschat et al. 2005_3 Prokaryota Calothrix Sp. n/a NA Schulz and Dickschat 2007 Prokaryota Plectonema Sp. n/a NA Schulz and Dickschat 2007 Prokaryota Phormidium Sp. n/a NA Schulz and Dickschat 2007 Prokaryota Spirulina Platensis n/a NA Schulz and Dickschat 2007 Prokaryota Cytophaga-Flavobacteria-Bacteroides Group n/a NA Schulz and Dickschat 2007 Prokaryota Cyanobacteria Sp. n/a NA Hoeckelmann et al. 2004 Prokaryota Calothrix Parietina n/a NA Hoeckelmann et al. 2004 Prokaryota Calothrix Sp. n/a NA Hoeckelmann et al. 2004 Prokaryota Plectonema Notatum n/a NA Hoeckelmann et al. 2004 Prokaryota Plectonema Sp. n/a NA Hoeckelmann et al. 2004 Prokaryota Tolypothrix Distorta n/a NA Hoeckelmann et al. 2004 Prokaryota Rivularia Sp. n/a NA Hoeckelmann et al. 2004 Prokaryota Rivularia Sp./Calothrix Parietina n/a NA Hoeckelmann et al. 2004

Method

Kingdom Species Growth Medium Applied Method Verification Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a n/a no Prokaryota Calothrix Sp. n/a n/a no Prokaryota Plectonema Sp. n/a n/a no Prokaryota Phormidium Sp. n/a n/a no Prokaryota Spirulina Platensis n/a n/a no Prokaryota Cytophaga-Flavobacteria-Bacteroides Group n/a n/a no Prokaryota Cyanobacteria Sp. n/a n/a no Prokaryota Calothrix Parietina n/a n/a no Prokaryota Plectonema Notatum n/a n/a no Prokaryota Tolypothrix Distorta n/a n/a no Prokaryota Rivularia Sp. n/a n/a no Prokaryota Rivularia Sp./Calothrix Parietina n/a n/a no