CHEBI:52669 - 2-amino-4,5-dihydroxy-6-oxo-7-(phosphonooxy)heptanoic acid

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ChEBI Name 2-amino-4,5-dihydroxy-6-oxo-7-(phosphonooxy)heptanoic acid
ChEBI ID CHEBI:52669
Definition A heptanoic acid having an amino-substituent at the 2-position, hydroxy-substituents at the 4- and 5-positions, an oxo-substituent at the 6-position and a phosphonooxy-substituent at the 7-position.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
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Formula C7H14NO9P
Net Charge 0
Average Mass 287.16110
Monoisotopic Mass 287.04062
InChI InChI=1S/C7H14NO9P/c8-3(7(12)13)1-4(9)6(11)5(10)2-17-18(14,15)16/h3-4,6,9,11H,1-2,8H2,(H,12,13)(H2,14,15,16)
InChIKey OABFYXXSGQYCAM-UHFFFAOYSA-N
SMILES NC(CC(O)C(O)C(=O)COP(O)(O)=O)C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing 2-amino-4,5-dihydroxy-6-oxo-7-(phosphonooxy)heptanoic acid (CHEBI:52669) has functional parent heptanoic acid (CHEBI:45571)
2-amino-4,5-dihydroxy-6-oxo-7-(phosphonooxy)heptanoic acid (CHEBI:52669) is a monoalkyl phosphate (CHEBI:25381)
2-amino-4,5-dihydroxy-6-oxo-7-(phosphonooxy)heptanoic acid (CHEBI:52669) is a oxo monocarboxylic acid (CHEBI:35871)
2-amino-4,5-dihydroxy-6-oxo-7-(phosphonooxy)heptanoic acid (CHEBI:52669) is conjugate acid of 2-azaniumyl-4,5-dihydroxy-6-oxo-7-(phosphonatooxy)heptanoate(2−) (CHEBI:58898)
Incoming 2-azaniumyl-4,5-dihydroxy-6-oxo-7-(phosphonatooxy)heptanoate(2−) (CHEBI:58898) is conjugate base of 2-amino-4,5-dihydroxy-6-oxo-7-(phosphonooxy)heptanoic acid (CHEBI:52669)
IUPAC Name
2-amino-4,5-dihydroxy-6-oxo-7-(phosphonooxy)heptanoic acid
Last Modified
02 July 2009