mzCloud – Clindamycin

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Systematic / IUPAC Name: Methyl (5R)-5-[(1S,2S)-2-chloro-1-{[(4R)-1-methyl-4-propyl-L-prolyl]amino}propyl]-1-thio-β-L-arabinopyranoside

ID: Reference1013

Other Names: 7(S)-Chloro-7-deoxylincomycin;
7-CDL;
7-Chloro-7-deoxylincomycin;
7-Chlorolincomycin;
7-Deoxy-7(S)-chlorolincomycin ; more

Formula: C₁₈H₃₃ClN₂O₅S

Class: Therapeutics/Prescription Drugs

Clindamycin mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Used Instruments	LTQ Orbitrap XL; Q Exactive Orbitrap
No. of Spectral Trees	2
No. of Spectra	109
Tandem Spectra	MS¹, MS²
Ionization Methods	ESI
Analyzers	FT
Last Modification	10/14/2016 11:21:48 AM

InChI	InChI=1S/C18H33ClN2O5S/c1-5-6-10-7-11(21(3)8-10)17(25)20-12(9(2)19)16-14(23)13(22)15(24)18(26-16)27-4/h9-16,18,22-24H,5-8H2,1-4H3,(H,20,25)/t9?,10-,11+,12?,13+,14-,15-,16-,18-/m1/s1
InChI Key	KDLRVYVGXIQJDK-NOWPCOIGSA-N
Canonical SMILES	CCCC1CC(N(C1)C)C(=O)NC(C2C(C(C(C(O2)SC)O)O)O)C(C)Cl
CAS	18323449
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Other Names	7(S)-Chloro-7-deoxylincomycin; 7-CDL; 7-Chloro-7-deoxylincomycin; 7-Chlorolincomycin; 7-Deoxy-7(S)-chlorolincomycin; Chlolincocin; Cleocin (TN); Clindamicina; Clindamycine; Clindamycinum; Dalacin C flavored granules; Dalacin T topical solution; Sobelin; Zindaclin; (2S,4R)-N-{2-Chloro-1-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(methylsulfanyl)oxan-2-yl]propyl}-1-methyl-4-propylpyrrolidine-2-carboxamide; L-Threo-α-D-galacto-octopyranoside, methyl 7-chloro-6,7,8-trideoxy-6-({[(2S,4R)-1-methyl-4-propyl-2-pyrrolidinyl]carbonyl}amino)-1-thio- ; L-Threo-α-D-galacto-octopyranoside, methyl 7-chloro-6,7,8-trideoxy-6-{[(1-methyl-4-propyl-2-pyrrolidinyl)carbonyl]amino}-1-thio, (2S-trans-)- ; L-Threo-D-galacto-octopyranoside, methyl 7-chloro-6,7,8-trideoxy-6-(1-methyl-4-propyl-L-2-pyrrolidinecarboxamido)-1-thio, trans-α-; Methyl 7-chloro-6,7,8-trideoxy-6-({[(2S,4R)-1-methyl-4-propylpyrrolidin-2-yl]carbonyl}amino)-1-thio-D-glycero-α-D-galacto-octopyranoside; Methyl 7-chloro-6,7,8-trideoxy-6-(1-methyl-trans-4-propyl-L-2-pyrrolidinecarboxamido)-1-thio-L-threo-α-D-galacto-octopyranoside