Results for:
PubChem ID: 91456

(1S,4S,5R)-4-methyl-1-propan-2-ylbicyclo[3.1.0]hexan-3-one

Compound Details

Synonymous names	beta-Thujone (+)-Isothujone (+)-3-Thujone (+)-Thujone 471-15-8 d-Isothujone (+)-beta-Thujone Isothujone THUJONE D-beta-Thujone (1S,4S,5R)-(+)-3-thujanone trans-thujone d-Thujone NSC 67392 3-Thujanone, (1S,4S,5R)-(+)- 8ZI5R3T54Q (1S,4S,5R)-1-isopropyl-4-methylbicyclo[3.1.0]hexan-3-one CHEBI:50045 (1s,4s,5r)-4-methyl-1-propan-2-ylbicyclo[3.1.0]hexan-3-one [1S-(1alpha,4beta,5alpha)]-4-methyl-1-(1-methylethyl)bicyclo[3.1.0]hexan-3-one cis-Thujone .beta.-Thujone (1S,4S,5R)-4-methyl-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-one (1S,4S,5R)-thujan-3-one (+)-thujan-3-one UNII-8ZI5R3T54Q NSC67392 beta Thujone AI3-11501 NSC-67392 D-beta thujone (trans-) (+)-cis-Thujone (+)-b-Thujone SCHEMBL337540 .BETA.-THUJONE [MI] (1S,4S,5R)-thujan-3-one CHEMBL3277898 DTXSID7057575 USMNOWBWPHYOEA-XKSSXDPKSA-N (1S,4S,5R)-4-methyl-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-one (+)-Isothujone ((+)-beta-Thujone) AKOS006240449 LMPR0102120039 Bicyclo(3.1.0)hexan-3-one, 4-methyl-1-(1-methylethyl)-, (1S-(1-alpha,4-beta,5-alpha))- NS00076400 C20260 Q27121861 BICYCLO(3.1.0)HEXAN-3-ONE, 4-METHYL-1-(1-METHYLETHYL)-, (1S,4S,5R)
Microorganism:	Yes
IUPAC name	(1S,4S,5R)-4-methyl-1-propan-2-ylbicyclo[3.1.0]hexan-3-one
SMILES	CC1C2CC2(CC1=O)C(C)C
Inchi	InChI=1S/C10H16O/c1-6(2)10-4-8(10)7(3)9(11)5-10/h6-8H,4-5H2,1-3H3/t7-,8+,10-/m0/s1
Formula	C10H16O
PubChem ID	91456
Molweight	152.23
LogP	2.3
Atoms	11
Bonds	1
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	terpenes ketones
CHEBI-ID	50045
Supernatural-ID	SN0378958-08

mVOC Specific Details

Species emitting the compound	Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Streptomyces Sp. n/a NA Dickschat et al. 2005_2 Prokaryota Streptomyces Caviscabies n/a NA Schulz and Dickschat 2007
Method	Kingdom Species Growth Medium Applied Method Verification Prokaryota Streptomyces Sp. n/a n/a no Prokaryota Streptomyces Caviscabies n/a n/a no