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Clindamycin phosphate

PropertiesImage
MNX_IDMNXM47229 Image of MNXM47229
referencekeggC:C11728
formulaC18H34ClN2O8PS
global charge0
mol weight504.97
InChIKeyUFUVLHLTWXBHGZ-MGZQPHGTSA-N
InChIInChI=1S/C18H34ClN2O8PS/c1-5-6-10-7-11(21(3)8-10)17(24)20-12(9(2)19)15-13(22)14(23)16(18(28-15)31-4)29-30(25,26)27/h9-16,18,22-23H,5-8H2,1-4H3,(H,20,24)(H2,25,26,27)/t9-,10+,11-,12+,13+,14-,15+,16+,18+/m0/s1
SMILESCCC[C@@H]1C[C@@H](C(=O)N[C@@H]([C@H]2O[C@H](SC)[C@H](OP(=O)(O)O)[C@@H](O)[C@H]2O)[C@H](C)Cl)N(C)C1
MNX internals
InChI (mnx)InChI=1/C18H34ClN2O8PS/c1-5-6-10-7-11(21(3)8-10)17(24)20-12(9(2)19)15-13(22)14(23)16(18(28-15)31-4)29-30(25,26)27/h9-16,18,22-23H,5-8H2,1-4H3,(H,20,24)(H2,25,26,27)/t9-,10+,11-,12+,13+,14-,15+,16+,18+/m0/s1 Image of MNXM47229
SMILES (mnx)[CH3:1][CH2:5][CH2:6][C@@H:10]1[CH2:7][C@@H:11]([C:17](=[N:20][C@H:12]([C@H:9]([CH3:2])[Cl:19])[C@@H:15]2[C@H:13]([OH:22])[C@H:14]([OH:23])[C@@H:16]([O:29][P:30]([OH:25])([OH:26])=[O:27])[C@@H:18]([S:31][CH3:4])[O:28]2)[OH:24])[N:21]([CH3:3])[CH2:8]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

seed.compound:cpd08537
seedM:cpd08537
kegg.compound:C11728
keggC:C11728
UFUVLHLTWXBHGZ-MGZQPHGTSA-M
UFUVLHLTWXBHGZ-MGZQPHGTSA-N 		Clindamycin phosphate

CHEBI:201756
chebi:201756
UFUVLHLTWXBHGZ-UHFFFAOYSA-N 		Clindamycin 2-Phosphate
[(2R,3R,4S,5R,6R)-6-[(1S,2S)-2-chloro-1-[[(2S,4R)-1-methyl-4-propylpyrrolidine-2-carbonyl]amino]propyl]-4,5-dihydroxy-2-methylsulanyloxan-3-yl] dihydrogen phosphate

kegg.drug:D01073
keggD:D01073
UFUVLHLTWXBHGZ-MGZQPHGTSA-N 		Clindamycin phosphate (JP18/USP)
Cleocin (TN)
Dalacin-S (TN)
Evoclin (TN)
hmdb:HMDB0250324
UFUVLHLTWXBHGZ-UHFFFAOYSA-N 		Clindamycin phosphate
(6-{2-chloro-1-[(1-methyl-4-propylpyrrolidin-2-yl)formamido]propyl}-4,5-dihydroxy-2-(methylsulfanyl)oxan-3-yl)oxyphosphonic acid
Cleocin phosphate
Clindamycin phosphoric acid
Clindamycin-2-phosphate
Clindesse
Clindets
[(6-{2-chloro-1-[(1-methyl-4-propylpyrrolidin-2-yl)formamido]propyl}-4,5-dihydroxy-2-(methylsulfanyl)oxan-3-yl)oxy]phosphonic acid

CHEBI:3746
chebi:3746
UFUVLHLTWXBHGZ-KUWMELJBSA-N 		clindamycin phosphate
Clindamycin phosphate
cleocin phosphate
clindagel
clindamycin-2-phosphate

keggC:M_C11728
keggD:M_D01073
seedM:M_cpd08537 		secondary/obsolete/fantasy identifier