Chem
J-GLOBAL ID：200907018528241154   Nikkaji number：J19.081K

UK-31214

プロピカシン
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： C21H43N5O12
Molecular formula furigana： C21-H43-N5-O12
Molecular weight： 557.598
InChI： InChI=1S/C21H43N5O12/c22-2-9-14(31)15(32)12(25)20(35-9)37-18-7(23)1-8(26-6(3-27)4-28)19(17(18)34)38-21-16(33)11(24)13(30)10(5-29)36-21/h6-21,26-34H,1-5,22-25H2/t7-,8+,9+,10+,11-,12+,13+,14+,15+,16+,17-,18+,19-,20+,21+/m0/s1
InChI key： ZEFUFVWPRPISAD-FLUPTLLOSA-N
SMILES： NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](NC(CO)CO)[C@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O
Systematic name  (3)：
  • 6-O-(3-アミノ-3-デオキシ-α-D-グルコピラノシル)-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-N1-[2-ヒドロキシ-1-(ヒドロキシメチル)エチル]-D-ストレプタミン
  • (2R,3S,4R,5R,6R)-5-アミノ-6-{[(1R,2S,3S,4R,6S)-6-アミノ-3-{[(2S,3R,4S,5S,6R)-4-アミノ-3,5-ジヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}-4-[(1,3-ジヒドロキシプロパン-2-イル)アミノ]-2-ヒドロキシシクロヘキシル]オキシ}-2-(アミノメチル)オキサン-3,4-ジオール
  • (2R,3S,4R,5R,6R)-5-amino-6-{[(1R,2S,3S,4R,6S)-6-amino-3-{[(2S,3R,4S,5S,6R)-4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4-[(1,3-dihydroxypropan-2-yl)amino]-2-hydroxycyclohexyl]oxy}-2-(aminomethyl)oxane-3,4-diol
Other name (4)：
  • プロピカシン
  • UK-31214
  • Propikacin
  • 6-O-(3-Amino-3-deoxy-α-D-glucopyranosyl)-4-O-(2,6-diamino-2,6-dideoxy-α-D-glucopyranosyl)-2-deoxy-N1-[2-hydroxy-1-(hydroxymethyl)ethyl]-D-streptamine
CAS registry number： 66887-96-5
KEGG DRUG： D05629
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM