井冈霉素? 12650-70-3

基本信息

• 中文名称井冈霉素?
• 英文名称Validamycin C
• 英文别名(3-{[4-(Hexopyranosyloxy)-2,3-dihydroxy-5-(hydroxymethyl)cyclohexyl]amino}-4,5,6-trihydroxy-1-cyclohexen-1-yl)methyl hexopyranoside;  (3-{[4-(hexopyranosyloxy)-2,3-dihydroxy-5-(hydroxymethyl)cyclohexyl]amino}-4,5,6-trihydroxycyclohex-1-en-1-yl)methyl hexopyranoside;  Hexopyranoside, [3-[[4-(hexopyranosyloxy)-2,3-dihydroxy-5-(hydroxymethyl)cyclohexyl]amino]-4,5,6-trihydroxy-1-cyclohexen-1-yl]methyl;  D-CHIRO-INOSITOL,1,5,6-TRIDEOXY-4-O-B-D-GLUCOPYRANOSYL-1-[[(1S,4R,5S,6S)-3-[(B-D-GLUCOPYRANOSYLOXY)METHYL]-4,5,6-TRIHYDROXY-2-CYCLOHEXEN-1-YL]AMINO]-5-(HYDROXYMETHYL)-;  Validamycin C;   展开∨
• CAS号12650-70-3
• 国际化联命名2-[[3-[[2,3-dihydroxy-5-(hydroxymethyl)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexyl]amino]-4,5,6-trihydroxycyclohexen-1-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
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物化属性

• 密度：1.74
• 沸点：961.9°C at 760 mmHg
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化学数据

• 分子量：659.6314[g/mol]
  化合物是否规范：True
  疏水参数计算参考值（XLogP3-AA）：-8.4
  准确质量：659.26366359
  同位素质量：659.26366359
  复杂度：978
  可旋转化学键数量：10
  氢键供体数量：15
  氢键受体计数：19
  拓扑极表面积：332
  重原子数量：45
  确定原子立构中心数量：0
  不确定原子立构中心数量：19
  确定化学键立构中心数量：0
  不确定化学键立构中心数量：0
  同位素原子计数：0
  共价键单元数量：1
  CACTVS Substructure Key Fingerprint：AAADcfB6PgAAAAAAAAAAAAAAAAAAAAAAAAA0SIEAAAAAAAAAAAAAHgAQCAAADTzxgAcACALABgCAAiBCAACAAAAgAAAACIAIAAgTFAIAoQAmUAAH0ACfMAPw8D8OAAAAAAAAAABAgAKUABCgAAAAAAAAAA==
  

英文SDS

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