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(4R,7R)-4-isopropenyl-7-methyloxepan-2-one

MNXM2946 is deprecated and here replaced by MNXM1107114
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1107114 Image of MNXM1107114
referencechebi:228
formulaC10H16O2
global charge0
mol weight168.236
InChIKeyDNWZWUWUDAGNJB-RKDXNWHRSA-N
InChIInChI=1S/C10H16O2/c1-7(2)9-5-4-8(3)12-10(11)6-9/h8-9H,1,4-6H2,2-3H3/t8-,9-/m1/s1
SMILESC=C(C)[C@@H]1CC[C@@H](C)OC(=O)C1
MNX internals
InChI (mnx)InChI=1/C10H16O2/c1-7(2)9-5-4-8(3)12-10(11)6-9/h8-9H,1,4-6H2,2-3H3/t8-,9-/m1/s1 Image of MNXM1107114
SMILES (mnx)[CH2:1]=[C:7]([CH3:2])[C@@H:9]1[CH2:5][CH2:4][C@@H:8]([CH3:3])[O:12][C:10](=[O:11])[CH2:6]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:228
chebi:228
lipidmaps:LMPR0102090058
lipidmapsM:LMPR0102090058
DNWZWUWUDAGNJB-RKDXNWHRSA-N 		(4R,7R)-4-isopropenyl-7-methyloxepan-2-one
(4R,7R)-4-Isopropenyl-7-methyl-2-oxo-oxepanone
(4R,7R)-7-methyl-4-(1-methylethen-1-yl)oxepan-2-one
(4R,7R)-7-methyl-4-(1-methylethenyl)oxepan-2-one
(4R,7R)-7-methyl-4-(prop-1-en-2-yl)oxepan-2-one

sabiork.compound:13471
sabiorkM:13471
kegg.compound:C11402
keggC:C11402
DNWZWUWUDAGNJB-RKDXNWHRSA-N 		(4R,7R)-4-Isopropenyl-7-methyl-2-oxo-oxepanone

seed.compound:cpd08256
seedM:cpd08256
DNWZWUWUDAGNJB-RKDXNWHRSA-N 		(4R,7R)-4-Isopropenyl-7-methyl-2-oxo-oxepanone
(4R,7R)-4-isopropenyl-7-methyl -2-oxo-oxepanone
(4R,7R)-4-isopropenyl-7-methyloxepan-2-one

SLM:000597855
slm:000597855
DNWZWUWUDAGNJB-RKDXNWHRSA-N 		(4R,7R)-4-isopropenyl-7-methyloxepan-2-one

metacyc.compound:CPD-10044
metacycM:CPD-10044
DNWZWUWUDAGNJB-RKDXNWHRSA-N 		(4R,7R)-4-isopropenyl-7-methyloxepan-2-one
(4R,7R)-4-isopropenyl-7-methyl -2-oxo-oxepanone

keggC:M_C11402
seedM:M_cpd08256 		secondary/obsolete/fantasy identifier