Ascorbate
(2R)-2-[(1S)-1,2-dihydroxyethyl]-3-hydroxy-5-oxo-2H-furan-4-olate
Molecular Identity
Ascorbate
(2R)-2-[(1S)-1,2-dihydroxyethyl]-3-hydroxy-5-oxo-2H-furan-4-olate
PubChem CID: 54679076
L-ascorbate is the L-enantiomer of ascorbate and conjugate base of L-ascorbic acid, arising from selective deprotonation of the 3-hydroxy group. Required for a range of essential metabolic reactions in all animals and plants. It has a role as a cofactor, a human metabolite and a Daphnia magna metabolite. It is a vitamin C and an ascorbate. It is a conjugate base of a L-ascorbic acid.
2D Structure
Properties
C6H7O6-
Molecular Formula
175.12
Molecular Weight
g/mol
175.0243
Exact Mass
Da
-1
XLogP
Drug-like (Lipinski: < 5)
110
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
6
H-Bond Acceptors
232
Complexity
SMILES
Canonical SMILES
SMILES: C(C(C1C(=C(C(=O)O1)[O-])O)O)OIsomeric SMILES
SMILES: C([C@@H]([C@@H]1C(=C(C(=O)O1)[O-])O)O)OSynonyms(17)
ascorbateL-ascorbate(1-)299-36-5CHEBI:38290RefChem:6521CHEBI:22651(2R)-2-((1S)-1,2-dihydroxyethyl)-4-hydroxy-5-oxo-2,5-dihydrofuran-3-olateL-AscorbateAscorbate anionL-Ascorbic acid, ion(1-)CIWBSHSKHKDKBQ-JLAZNSOCSA-MDTXSID201318636Q27104442Q27104856(2R)-2-[(1S)-1,2-dihydroxyethyl]-3-hydroxy-5-oxo-2H-furan-4-olate
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Ascorbate
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