Chemical Compound

(1R,5S,8R,10aS)-3-Imino-9-(hydroxymethyl)-4a,8-methano-1,5-epoxy-1,2,3,4,4a,5,6,9,10,10a-decahydro-8H-7-oxa-2,4-diazabenzocyclooctene-6,9,11-triol

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(1R,5S,8R,10aS)-3-Imino-9-(hydroxymethyl)-4a,8-methano-1,5-epoxy-1,2,3,4,4a,5,6,9,10,10a-decahydro-8H-7-oxa-2,4-diazabenzocyclooctene-6,9,11-triol 结构式
Primary record

(1R,5S,8R,10aS)-3-Imino-9-(hydroxymethyl)-4a,8-methano-1,5-epoxy-1,2,3,4,4a,5,6,9,10,10a-decahydro-8H-7-oxa-2,4-diazabenzocyclooctene-6,9,11-triol

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
102335475
SMILES
C1[C@@H]2[C@@H]3N=C(NC24[C@H](O3)C(O[C@H](C4O)C1(CO)O)O)N
Canonical SMILES
NC1=N[C@@H]2O[C@@H]3C(O)O[C@@H]4C(O)C3(N1)[C@@H]2CC4(O)CO

名称与同义词

  • hemiketalTTX
  • 4,9-Anhydro-10-hemiketal-5-deoxytetrodotoxin
  • J3.333.013H
  • (1R,5S,8R,10aS)-3-Imino-9-(hydroxymethyl)-4a,8-methano-1,5-epoxy-1,2,3,4,4a,5,6,9,10,10a-decahydro-8H-7-oxa-2,4-diazabenzocyclooctene-6,9,11-triol
  • (5R,7S,10R,13S)-11-(hydroxymethyl)-3-imino-6,9-dioxa-2,4-diazatetracyclo[8.3.1.01,7.05,13]tetradecane-8,11,14-triol