Mcb-3837
7-[4-[[4-[(5S)-5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenoxy]methyl]-4-phosphonooxypiperidin-1-yl]-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid
Molecular Identity
Mcb-3837
7-[4-[[4-[(5S)-5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenoxy]methyl]-4-phosphonooxypiperidin-1-yl]-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid
PubChem CID: 44201350
2D Structure
Properties
C31H33F2N4O11P
Molecular Formula
706.60
Molecular Weight
g/mol
706.1852
Exact Mass
Da
2
XLogP
Drug-like (Lipinski: < 5)
195
TPSA
May have limited oral absorption
4
H-Bond Donors
15
H-Bond Acceptors
1390
Complexity
SMILES
Canonical SMILES
SMILES: CC(=O)NCC1CN(C(=O)O1)C2=CC(=C(C=C2)OCC3(CCN(CC3)C4=C(C=C5C(=C4)N(C=C(C5=O)C(=O)O)C6CC6)F)OP(=O)(O)O)FIsomeric SMILES
SMILES: CC(=O)NC[C@H]1CN(C(=O)O1)C2=CC(=C(C=C2)OCC3(CCN(CC3)C4=C(C=C5C(=C4)N(C=C(C5=O)C(=O)O)C6CC6)F)OP(=O)(O)O)FSynonyms(20)
OxaquinMCB-3837UNII-1221R21ZRQ7-[4-[[4-[(5S)-5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenoxy]methyl]-4-phosphonooxypiperidin-1-yl]-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid3-Quinolinecarboxylic acid, 7-(4-((4-((5S)-5-((acetylamino)methyl)-2-oxo-3-oxazolidinyl)-2-fluorophenoxy)methyl)-4-(phosphonooxy)-1-piperidinyl)-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-(4-((4-((5S)-5-(Acetamidomethyl)-2-oxo-oxazolidin-3-yl)-2-fluoro-phenoxy)methyl)-4-phosphonooxy-1-piperidyl)-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid7-(4-((4-((5S)-5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl)-2-fluorophenoxy)methyl)-4-phosphonooxypiperidin-1-yl)-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acidRefChem:156083DNV 3837QUINOLONYL-OXAZOLIDINONE ANTIBIOTIC DNV3837790704-50-61221R21ZRQMCB 3837(S)-7-(4-((4-(5-(Acetamidomethyl)-2-oxooxazolidin-3-yl)-2-fluorophenoxy)methyl)-4-(phosphonooxy)piperidin-1-yl)-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acidorb1708960
Data from PubChem (NCBI)
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