909014-86-4 Purity
96%
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Specification
The PubChem CID for Dehydro clindamycin is 71315302.
The molecular formula of Dehydro clindamycin is C18H31ClN2O5S.
The synonyms for Dehydro clindamycin include: Dehydro Clindamycin, 909032-77-5, N-[2-Chloro-1-[(3R,4R,6R)-3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl]propyl]-1-methyl-4-propyl-2,5-dihydropyrrole-2-carboxamide, DTXSID40747442, Methyl 7-chloro-6,7,8-trideoxy-6-[(1-methyl-4-propyl-2,5-dihydro-1H-pyrrole-2-carbonyl)amino]-1-thio-beta-L-threo-octopyranoside.
The molecular weight of Dehydro clindamycin is 423.0 g/mol.
The IUPAC name of Dehydro clindamycin is N-[2-chloro-1-[(3R,4R,6R)-3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl]propyl]-1-methyl-4-propyl-2,5-dihydropyrrole-2-carboxamide.
The InChI for Dehydro clindamycin is InChI=1S/C18H31ClN2O5S/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/h7,9,11-16,18,22-24H,5-6,8H2,1-4H3,(H,20,25)/t9?,11?,12?,13-,14-,15?,16?,18-/m1/s1.
The InChIKey for Dehydro clindamycin is RMQIGGGBJDZABU-VNCRYVLQSA-N.
The canonical SMILES for Dehydro clindamycin is CCCC1=CC(N(C1)C)C(=O)NC(C2C(C(C(C(O2)SC)O)O)O)C(C)Cl.
The isomeric SMILES for Dehydro clindamycin is CCCC1=CC(N(C1)C)C(=O)NC(C2[C@@H]([C@H](C([C@H](O2)SC)O)O)O)C(C)Cl.
Yes, Dehydro clindamycin is a canonicalized compound.