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(+)-thujan-3-one

MNXM97354 is deprecated and here replaced by MNXM741732
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM741732 Image of MNXM741732
referencechebi:50043
formulaC10H16O
global charge0
mol weight152.237
InChIKeyUSMNOWBWPHYOEA-OYNCUSHFSA-N
InChIInChI=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
SMILESCC(C)[C@@]12CC(=O)[C@@H](C)[C@@H]1C2
MNX internals
InChI (mnx)InChI=1/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 Image of MNXM741732
SMILES (mnx)[CH3:1][CH:6]([CH3:2])[C@:10]12[CH2:4][C@H:8]1[C@H:7]([CH3:3])[C:9](=[O:11])[CH2:5]2
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:50043
chebi:50043
USMNOWBWPHYOEA-OYNCUSHFSA-N 		(+)-thujan-3-one
(+)-3-Thujone
(+)-Isothujone
(+)-Thujone
(+)-alpha-thujone
(1R,4S,5S)-1-isopropyl-4-methylbicyclo[3.1.0]hexan-3-one
(1R,4S,5S)-4-methyl-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-one
(1R,4S,5S)-thujan-3-one
(1S,4S,5R)-(+)-3-Thujanone
d-Isothujone
d-Thujone

lipidmaps:LMPR0102120050
lipidmapsM:LMPR0102120050
USMNOWBWPHYOEA-OYNCUSHFSA-N 		(+)-alpha-thujone
(1R,4S,5S)-1-isopropyl-4-methylbicyclo[3.1.0]hexan-3-one
(1R,4S,5S)-4-methyl-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-one (1R,4S,5S)-thujan-3-one

chebi:63903 		secondary/obsolete/fantasy identifier