2-Acetamido-3-[(E)-(1-Aminoethylidene)Amino]-2,3-Dideoxy-L-Guluronic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C10H17N3O6
IUPAC Name (2r,3s,4r,5s)-5-acetamido-4-[(e)-1-aminoethylideneamino]-2,3-dihydroxy-6-oxo-hexanoic acid
Molecular Mass 275.258 g·mol−1
Heat of Formation -1106.4 ± 16.7 kJ·mol−1
Dipole Moment 3.77 ± 1.08 D
Volume 317.64 Å 3
Surface Area 263.78 Å 2
HOMO Energy -9.42 ± 0.55 eV
LUMO Energy 0.37 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3s,4r,5s)-5-acetamido-4-(1-aminoethylideneamino)-2,3-dihydroxy-6-keto-hexanoic acid
  • (2r,3s,4r,5s)-5-acetamido-4-(1-aminoethylideneamino)-2,3-dihydroxy-6-oxo-hexanoic acid
  • (2r,3s,4r,5s)-5-acetamido-4-(1-aminoethylideneamino)-2,3-dihydroxy-6-oxohexanoic acid
  • 3-acetamidino-2-acetamido-2,3-dideoxyguluronic acid
  • gulnacama
CAS Number(s)
  • 104602-08-6
InChIKey DHMWLSNODZWOTC-LURQLKTLSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N