Chem
J-GLOBAL ID：200907068096062072   Nikkaji number：J32.482E

Pirlimycin

ピルリマイシン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C17H31ClN2O5S
Molecular formula furigana： C17-H31-CL-N2-O5-S
Molecular weight： 410.950
InChI： InChI=1S/C17H31ClN2O5S/c1-4-9-5-6-19-10(7-9)16(24)20-11(8(2)18)15-13(22)12(21)14(23)17(25-15)26-3/h8-15,17,19,21-23H,4-7H2,1-3H3,(H,20,24)/t8-,9+,10-,11+,12-,13+,14+,15+,17+/m0/s1
InChI key： HBJOXQRURQPDEX-MHXMMLMNSA-N
SMILES： CC[C@@H]1CCN[C@@H](C1)C(=O)N[C@H]([C@H](C)Cl)[C@H]1O[C@H](SC)[C@H](O)[C@@H](O)[C@H]1O
Systematic name  (3)：
  • メチル7-クロロ-6,7,8-トリデオキシ-6-[[[(2S,4R)-4-エチル-2-ピペリジニル]カルボニル]アミノ]-1-チオ-L-threo-α-D-galacto-オクトピラノシド
  • (2S,4R)-N-[(1S,2S)-2-クロロ-1-[(2R,3R,4S,5R,6R)-3,4,5-トリヒドロキシ-6-(メチルスルファニル)オキサン-2-イル]プロピル]-4-エチルピペリジン-2-カルボキサミド
  • (2S,4R)-N-[(1S,2S)-2-chloro-1-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(methylsulfanyl)oxan-2-yl]propyl]-4-ethylpiperidine-2-carboxamide
Other name (3)：
  • ピルリマイシン
  • Pirlimycin
  • Methyl 7-chloro-6,7,8-trideoxy-6-[[[(2S,4R)-4-ethyl-2-piperidinyl]carbonyl]amino]-1-thio-L-threo-α-D-galacto-octopyranoside
CAS registry number： 79548-73-5
KEGG DRUG： D08391
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