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Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2012-09-12 02:44:30 UTC
Update Date2022-03-07 02:56:53 UTC
HMDB IDHMDB0041096
Secondary Accession Numbers
  • HMDB41096
Metabolite Identification
Common NameLepidimoic acid
DescriptionLepidimoic acid, also known as lepidimoate, belongs to the class of organic compounds known as disaccharides. Disaccharides are compounds containing two carbohydrate moieties linked to each to each other through a glycosidic bond, no set of three or more glycosidically linked carbohydrate units. Lepidimoic acid has been detected, but not quantified in, brassicas and garden cresses (Lepidium sativum). This could make lepidimoic acid a potential biomarker for the consumption of these foods. Based on a literature review very few articles have been published on Lepidimoic acid.
Structure
Thumb
Synonyms
ValueSource
LepidimoateGenerator
1-Methyl-3-phenyl-5-(3-propoxyphenyl)pyridin-4-oneHMDB
2-O-L-Ramnopyranosyl-4-deoxy-alpha-L-threo-hex-4-enopyranosiduronoic acidHMDB
6-Deoxy-2-O-(4-deoxy-b-L-threo-hex-4-enopyranuronosyl)-L-mannose, 9ciHMDB
LepidimoideHMDB
3,4-Dihydroxy-2-[(2,4,5-trihydroxy-6-methyloxan-3-yl)oxy]-3,4-dihydro-2H-pyran-6-carboxylateGenerator
2-O-L-Rhamnopyranosyl-4-deoxy-alpha-L-threo-hex-4-enopyranosiduronateMeSH
Chemical FormulaC12H18O10
Average Molecular Weight322.2653
Monoisotopic Molecular Weight322.089996796
IUPAC Name3,4-dihydroxy-2-[(2,4,5-trihydroxy-6-methyloxan-3-yl)oxy]-3,4-dihydro-2H-pyran-6-carboxylic acid
Traditional Name4,5-dihydroxy-6-[(2,4,5-trihydroxy-6-methyloxan-3-yl)oxy]-5,6-dihydro-4H-pyran-2-carboxylic acid
CAS Registry Number157676-09-0
SMILES
CC1OC(O)C(OC2OC(=CC(O)C2O)C(O)=O)C(O)C1O
InChI Identifier
InChI=1S/C12H18O10/c1-3-6(14)8(16)9(11(19)20-3)22-12-7(15)4(13)2-5(21-12)10(17)18/h2-4,6-9,11-16,19H,1H3,(H,17,18)
InChI KeyPBUKNNGDHZLXKG-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as disaccharides. Disaccharides are compounds containing two carbohydrate moieties linked to each to each other through a glycosidic bond, no set of three or more glycosidically linked carbohydrate units.
KingdomOrganic compounds
Super ClassOrganic oxygen compounds
ClassOrganooxygen compounds
Sub ClassCarbohydrates and carbohydrate conjugates
Direct ParentDisaccharides
Alternative Parents
Substituents
  • Disaccharide
  • Oxane
  • Hemiacetal
  • Secondary alcohol
  • Acetal
  • Carboxylic acid derivative
  • Carboxylic acid
  • Monocarboxylic acid or derivatives
  • Oxacycle
  • Organoheterocyclic compound
  • Polyol
  • Hydrocarbon derivative
  • Carbonyl group
  • Alcohol
  • Organic oxide
  • Aliphatic heteromonocyclic compound
Molecular FrameworkAliphatic heteromonocyclic compounds
External DescriptorsNot Available
Ontology
Physiological effectNot Available
Disposition
ProcessNot Available
Role
Physical Properties
StateNot Available
Experimental Molecular Properties
PropertyValueReference
Melting PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water Solubility1000000 mg/L @ 25 °C (est)The Good Scents Company Information System
LogPNot AvailableNot Available
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
Predicted Chromatographic Properties
Spectra
Biological Properties
Cellular LocationsNot Available
Biospecimen LocationsNot Available
Tissue LocationsNot Available
Pathways
Normal Concentrations
Not Available
Abnormal Concentrations
Not Available
Associated Disorders and Diseases
Disease ReferencesNone
Associated OMIM IDsNone
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FooDB IDFDB020978
KNApSAcK IDC00007670
Chemspider ID3677082
KEGG Compound IDNot Available
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound4479101
PDB IDNot Available
ChEBI ID169657
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDNot Available
Good Scents IDrw1889541
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Not Available
General References
  1. Kato-Noguchi H, Yamada K, Hasegawa K: Lepidimoic acid increases fructose 2,6-bisphosphate in Amaranthus seedlings. Phytochemistry. 2001 Mar;56(5):499-503. [PubMed:11261583 ]
  2. (). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .