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English
Lincomycin A
group of stereoisomers with the chemical formula C₁₈H₃₄N₂O₆S
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Statements
instance of
group of stereoisomers
0 references
subclass of
pyrrolidine alkaloid
1 reference
inferred from
pyrrolidine alkaloid
mass
406.2137578079999
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₁₈H₃₄N₂O₆S
0 references
canonical SMILES
CCCC1CC(C(=O)NC(C(C)O)C2OC(SC)C(O)C(O)C2O)N(C)C1
0 references
isomeric SMILES
CCC[C@@H]1C[C@@H](C(=O)N[C@@H](C(C)O)C2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)N(C)C1
0 references
Identifiers
InChI
InChI=1S/C18H34N2O6S/c1-5-6-10-7-11(20(3)8-10)17(25)19-12(9(2)21)16-14(23)13(22)15(24)18(26-16)27-4/h9-16,18,21-24H,5-8H2,1-4H3,(H,19,25)/t9?,10-,11+,12+,13+,14-,15-,16?,18-/m1/s1
0 references
InChIKey
OJMMVQQUTAEWLP-ZUWRKQLMSA-N
0 references
CAS Registry Number
12768-69-3
0 references
PubChem CID
9063
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
284033
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50925936
0 references
DSSTOX compound identifier
DTXCID201354757
0 references
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