Chem
J-GLOBAL ID：200907092826677300   Nikkaji number：J247.918D

Istamycin A-3

イスタマイシンA3
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： C18H36N6O5
Molecular formula furigana： C18-H36-N6-O5
Molecular weight： 416.523
InChI： InChI=1S/C18H36N6O5/c1-22-7-10-4-5-11(20)18(28-10)29-17-12(21)6-13(27-3)15(16(17)26)24(2)14(25)8-23-9-19/h9-13,15-18,22,26H,4-8,20-21H2,1-3H3,(H2,19,23)/t10-,11+,12-,13-,15+,16+,17+,18+/m0/s1
InChI key： FBYTVIISAJWXNX-GTSDWETFSA-N
SMILES： CNC[C@@H]1CC[C@@H](N)[C@@H](O[C@@H]2[C@@H](N)C[C@H](OC)[C@H]([C@H]2O)N(C)C(=O)CNC=N)O1
Systematic name  (3)：
  • 4-アミノ-3-O-[2-アミノ-2,3,4,6-テトラデオキシ-6-(メチルアミノ)-α-D-erythro-ヘキソピラノシル]-1,4,5-トリデオキシ-1-[[[(イミノメチル)アミノ]アセチル]メチルアミノ]-6-O-メチル-L-chiro-イノシトール
  • N-[(1S,2R,3R,4S,6S)-4-アミノ-3-{[(2R,3R,6S)-3-アミノ-6-[(メチルアミノ)メチル]オキサン-2-イル]オキシ}-2-ヒドロキシ-6-メトキシシクロヘキシル]-2-メタンイミドアミド-N-メチルアセトアミド
  • N-[(1S,2R,3R,4S,6S)-4-amino-3-{[(2R,3R,6S)-3-amino-6-[(methylamino)methyl]oxan-2-yl]oxy}-2-hydroxy-6-methoxycyclohexyl]-2-methanimidamido-N-methylacetamide
Other name (5)：
  • 2′′-N-Formimidoylistamycin A
  • イスタマイシンA3
  • 2′′-N-ホルムイミドイルイスタマイシンA
  • Istamycin A-3
  • 4-Amino-3-O-[2-amino-2,3,4,6-tetradeoxy-6-(methylamino)-α-D-erythro-hexopyranosyl]-1,4,5-trideoxy-1-[[[(iminomethyl)amino]acetyl]methylamino]-6-O-methyl-L-chiro-inositol
CAS registry number： 81202-83-7
KEGG COMPOUND： C17989
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