potassium (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-{[(1Z,4E)-5-methanesulfinyl-1-[(sulfonatooxy)imino]pent-4-en-1-yl]sulfanyl}oxane-3,4,5-triol, Glucoraphenin potassium
HIT218832945
sdf文件结构编辑类似物检索
HIT ID: HIT218832945
Cas No:
分子式: C12H20KNO10S3
分子量: 473.57
常用名: potassium (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-{[(1Z,4E)-5-methanesulfinyl-1-[(sulfonatooxy)imino]pent-4-en-1-yl]sulfanyl}oxane-3,4,5-triol, Glucoraphenin potassium
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: potassium (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-{[(1Z,4E)-5-methanesulfinyl-1-[(sulfonatooxy)imino]pent-4-en-1-yl]sulfanyl}oxane-3,4,5-triol
SMILES: [K+].CS(=O)\C=C\CC\C(S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=N\OS([O-])(=O)=O
InChI key: SPAAOAFFSVKBJP-SMHDNHKFSA-M
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