Chem
J-GLOBAL ID：200907020738149808   Nikkaji number：J87.136B

JI-20A

抗生物質JI-20A
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： C19H39N5O9
Molecular formula furigana： C19-H39-N5-O9
Molecular weight： 481.547
InChI： InChI=1S/C19H39N5O9/c1-19(29)5-30-18(13(28)16(19)24-2)33-15-7(22)3-6(21)14(12(15)27)32-17-9(23)11(26)10(25)8(4-20)31-17/h6-18,24-29H,3-5,20-23H2,1-2H3/t6-,7+,8+,9+,10+,11+,12-,13+,14+,15-,16+,17+,18+,19-/m0/s1
InChI key： YQGZDAPJXRYYLX-ZFAMMYHGSA-N
SMILES： CN[C@@H]1[C@@H](O)[C@@H](O[C@H]2[C@H](N)C[C@H](N)[C@@H](O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)OC[C@]1(C)O
Systematic name  (4)：
  • 6-O-[4-C-メチル-3-(メチルアミノ)-3-デオキシ-β-L-アラビノピラノシル]-4-O-(2,6-ジアミノ-2,6-ジデオキシ-α-D-グルコピラノシル)-2-デオキシ-D-ストレプタミン
  • 4-O-(2,6-ジアミノ-2,6-ジデオキシ-α-D-グルコピラノシル)-6-O-(3-メチルアミノ-4-C-メチル-3-デオキシ-β-L-アラビノピラノシル)-2-デオキシ-D-ストレプタミン
  • (2R,3R,4R,5R)-2-{[(1S,2S,3R,4S,6R)-4,6-ジアミノ-3-{[(2R,3R,4R,5S,6R)-3-アミノ-6-(アミノメチル)-4,5-ジヒドロキシオキサン-2-イル]オキシ}-2-ヒドロキシシクロヘキシル]オキシ}-5-メチル-4-(メチルアミノ)オキサン-3,5-ジオール
  • (2R,3R,4R,5R)-2-{[(1S,2S,3R,4S,6R)-4,6-diamino-3-{[(2R,3R,4R,5S,6R)-3-amino-6-(aminomethyl)-4,5-dihydroxyoxan-2-yl]oxy}-2-hydroxycyclohexyl]oxy}-5-methyl-4-(methylamino)oxane-3,5-diol
Other name (5)：
  • 抗生物質JI-20A
  • Antibiotic JI-20A
  • JI-20A
  • 6-O-[4-C-Methyl-3-(methylamino)-3-deoxy-β-L-arabinopyranosyl]-4-O-(2,6-diamino-2,6-dideoxy-α-D-glucopyranosyl)-2-deoxy-D-streptamine
  • 4-O-(2,6-Diamino-2,6-dideoxy-α-D-glucopyranosyl)-6-O-(3-methylamino-4-C-methyl-3-deoxy-β-L-arabinopyranosyl)-2-deoxy-D-streptamine
CAS registry number： 51846-97-0
Regulation number (1)：
  • WK2281000
KEGG COMPOUND： C17704
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