[3-Hydroxy-2-methyl-5-phosphonooxymethyl-pyridin-4-ylmethyl]-serine
(2S)-3-hydroxy-2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridinyl]methylamino]propanoic acid
Molecular Identity
[3-Hydroxy-2-methyl-5-phosphonooxymethyl-pyridin-4-ylmethyl]-serine
(2S)-3-hydroxy-2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridinyl]methylamino]propanoic acid
PubChem CID: 444550
2D Structure
Properties
C11H17N2O8P
Molecular Formula
336.23
Molecular Weight
g/mol
336.0723
Exact Mass
Da
-4.5
XLogP
Drug-like (Lipinski: < 5)
169
TPSA
May have limited oral absorption
6
H-Bond Donors
10
H-Bond Acceptors
417
Complexity
SMILES
Canonical SMILES
SMILES: CC1=NC=C(C(=C1O)CNC(CO)C(=O)O)COP(=O)(O)OIsomeric SMILES
SMILES: CC1=NC=C(C(=C1O)CN[C@@H](CO)C(=O)O)COP(=O)(O)OSynonyms(7)
[3-hydroxy-2-methyl-5-phosphonooxymethyl-pyridin-4-ylmethyl]-serinePLSKOUPYRIDOXYL-SERINE-5-MONOPHOSPHATEEVMQ27464475N-({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methyl)-L-serine
Data from PubChem (NCBI)
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Molecular Structure
[3-Hydroxy-2-methyl-5-phosphonooxymethyl-pyridin-4-ylmethyl]-serine
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Drug Network
Trials and conditions connected to [3-Hydroxy-2-methyl-5-phosphonooxymethyl-pyridin-4-ylmethyl]-serine
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