glucoberteroin
Molecular Formula:
C13H24NO9S3-
InChI: InChI=1/C13H25NO9S3/c1-24-6-4-2-3-5-9(14-23-26(19,20)21)25-13-12(18)11(17)10(16)8(7-15)22-13/h8,10-13,15-18H,2-7H2,1H3,(H,19,20,21)/p-1/t8-,10-,11+,12-,13+/m1/s1/fC13H24NO9S3/q-1
InChIKey: InChIKey=MEFPHTVXBPLRLX-YRYKKZRZDE
SMILES: CSCCCCCC(S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=NOS([O-])(=O)=O
Names:
C08401
Glucoberteroin
glucoberteroin
Glucopyranose, 1-thio-, 1-(6-(methylthio)hexanohydroximate)NO-(hydrogen sulfate), beta-D-
Glucopyranose, 1-thio-, 1-(6-(methylthio)hexanohydroximate)
Glucopyranose, 1-thio-, 1-(6-(methylthio)hexanohydroximate) NO-(hydrogen sulfate), beta-D-
(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-2-(hydroxymethyl)-6-(C-(5-methylsulfanylpentyl)-N-sulfonatooxy-carbonimidoyl)sulfanyl-oxane
29611-01-6
Registries:
PubChem CID 656524
ChEBI 5396
Kegg C08401
PubChem ID 10597
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