Chemical Component Summary

NameN-({(2E)-3-[4-(propan-2-yl)phenyl]prop-2-enoyl}carbamoyl)-beta-D-glucopyranosylamine
Identifiers(E)-N-[[(2R,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]carbamoyl]-3-(4-propan-2-ylphenyl)prop-2-enamide
FormulaC19 H26 N2 O7
Molecular Weight394.419
TypeNON-POLYMER
Isomeric SMILESCC(C)c1ccc(cc1)/C=C/C(=O)NC(=O)N[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O
InChIInChI=1S/C19H26N2O7/c1-10(2)12-6-3-11(4-7-12)5-8-14(23)20-19(27)21-18-17(26)16(25)15(24)13(9-22)28-18/h3-8,10,13,15-18,22,24-26H,9H2,1-2H3,(H2,20,21,23,27)/b8-5+/t13-,15-,16+,17-,18-/m1/s1
InChIKeyRIYKPZZUXJMBTL-AWRGUQPNSA-N

Chemical Details

Formal Charge0
Atom Count54
Chiral Atom Count5
Bond Count55
Aromatic Bond Count6

Related Resource References

Resource NameReference
PubChem 122396753