Met000559: C20912
Metabolite Information
Name
C20912
IUPAC Name
(5S)-5-acetamido-1-aminopentane-1,2,5-tricarboxylic acid
Molecular Formula
C10H16N2O7
Molecular Weight
276.24
Exact Mass
276.0957509
SMILES
CC(=O)NC(CCC(C(C(=O)O)N)C(=O)O)C(=O)O
InChIKey
PCVHORXNFNXSQG-HUDPQJTASA-N
InChI
InChI=1S/C10H16N2O7/c1-4(13)12-6(9(16)17)3-2-5(8(14)15)7(11)10(18)19/h5-7H,2-3,11H2,1H3,(H,12,13)(H,14,15)(H,16,17)(H,18,19)/t5?,6-,7?/m0/s1
Other Databases Link
Structure
2D Structure
3D Structure
Classification
(data sourced from ClassyFire)
Kingdom:
Organic compounds
Superclass:
Organic acids and derivatives
Class:
Carboxylic acids and derivatives
Subclass:
Amino acids, peptides, and analogues
Crops containing this metabolite
asparagus
cauliflower
cowpea
onion
tomato
cauliflower
cowpea
onion
tomato
Metabolite Spectrum Accession Label