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1,6,6-trimethyl-2,7-dioxabicyclo[3.2.2]nonan-3-one

PropertiesImage
MNX_IDMNXM2762 Image of MNXM2762
referencechebi:29064
formulaC10H16O3
global charge0
mol weight184.235
InChIKeyKAUZXNDCPVMFCH-UHFFFAOYSA-N
InChIInChI=1S/C10H16O3/c1-9(2)7-4-5-10(3,13-9)12-8(11)6-7/h7H,4-6H2,1-3H3
SMILESCC12CCC(CC(=O)O1)C(C)(C)O2
MNX internals
InChI (mnx)InChI=1/C10H16O3/c1-9(2)7-4-5-10(3,13-9)12-8(11)6-7/h7H,4-6H2,1-3H3/t7?,10? Image of MNXM2762
SMILES (mnx)[CH3:1][C:9]1([CH3:2])[CH:7]2[CH2:4][CH2:5][C:10]([CH3:3])([O:12][C:8](=[O:11])[CH2:6]2)[O:13]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:29064
chebi:29064
KAUZXNDCPVMFCH-UHFFFAOYSA-N
1,6,6-trimethyl-2,7-dioxabicyclo[3.2.2]nonan-3-one
1,6,6-Trimethyl-2,7-dioxabicyclo[3.2.2]nonan-3-one
1,6,6-trimethyl-2,7-dioxabicyclo-[3.2.2]nonan-3-one

kegg.compound:C04718
keggC:C04718
KAUZXNDCPVMFCH-UHFFFAOYSA-N
1,6,6-Trimethyl-2,7-dioxabicyclo[3.2.2]nonan-3-one

seed.compound:cpd02874
seedM:cpd02874
KAUZXNDCPVMFCH-UHFFFAOYSA-N
1,6,6-Trimethyl-2,7-dioxabicyclo[3.2.2]nonan-3-one
1,6,6-trimethyl-2,7-dioxabicyclo(3,2,2)nonan-3-one
1,6,6-trimethyl-2,7-dioxobicyclo-(3,2,2)nonan-3-one

metacyc.compound:CPD-788
metacycM:CPD-788
KAUZXNDCPVMFCH-UHFFFAOYSA-N
1,6,6-trimethyl-2,7-dioxobicyclo-(3,2,2)nonan-3-one
1,6,6-trimethyl-2,7-dioxabicyclo(3,2,2)nonan-3-one

chebi:11177
chebi:18947
chebi:552
keggC:M_C04718
seedM:M_cpd02874
secondary/obsolete/fantasy identifier