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heptylmalonic acid

PropertiesImage
MNX_IDMNXM105531 Image of MNXM105531
referencechebi:70747
formulaC10H18O4
global charge0
mol weight202.25
InChIKeyYSFZWUJOBANROZ-UHFFFAOYSA-N
InChIInChI=1S/C10H18O4/c1-2-3-4-5-6-7-8(9(11)12)10(13)14/h8H,2-7H2,1H3,(H,11,12)(H,13,14)
SMILESCCCCCCCC(C(=O)O)C(=O)O
MNX internals
InChI (mnx)InChI=1/C10H18O4/c1-2-3-4-5-6-7-8(9(11)12)10(13)14/h8H,2-7H2,1H3,(H,11,12)(H,13,14) Image of MNXM105531
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH:8]([C:9](=[O:11])[OH:12])[C:10](=[O:13])[OH:14]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:70747
chebi:70747
YSFZWUJOBANROZ-UHFFFAOYSA-N 		heptylmalonic acid
2-heptylmalonic acid
2-heptylpropanedioic acid
heptylpropanedioic acid
n-Heptylmalonic acid
hmdb:HMDB0059719
YSFZWUJOBANROZ-UHFFFAOYSA-N 		Heptylmalonic acid
2-Heptylmalonate
2-Heptylmalonic acid
2-Heptylpropanedioate
2-Heptylpropanedioic acid
2-heptylpropanedioic acid
Heptylmalonate
N-Heptylmalonate
N-Heptylmalonic acid
propanedioic acid, heptyl-

hmdb:HMDB59719 		secondary/obsolete/fantasy identifier