Nanafrocin

Molecule SVG Image

Properties Simple | Detailed

Formula C16H14O6
IUPAC Name 2-[(1s,3r)-9-hydroxy-1-methyl-5,10-dioxo-3,4-dihydro-1h-benzo[g]isochromen-3-yl]acetic acid
Molecular Mass 302.279 g·mol−1
Heat of Formation -893.9 ± 16.7 kJ·mol−1
Dipole Moment 3.61 ± 1.08 D
Volume 332.36 Å 3
Surface Area 294.79 Å 2
HOMO Energy -9.76 ± 0.55 eV
LUMO Energy 1.29 ± eV
Point Group Symmetry C1
Synonyms
  • (1s,3r)-nanaomycin a
  • 1h-naphtho[2,3-c]pyran-3-acetic acid,3,4,5,10-tetrahydro-9-hydroxy-1-methyl-5,10-dioxo-(1s,3r)-
  • 2-[(1s,3r)-9-hydroxy-1-methyl-5,10-dioxo-3,4-dihydro-1h-benzo[g]isochromen-3-yl]ethanoic acid
  • 2-[(1s,3r)-9-hydroxy-5,10-diketo-1-methyl-3,4-dihydro-1h-benzo[g]isochromen-3-yl]acetic acid
CAS Number(s)
  • 52934-83-5
InChIKey ZCJHPTKRISJQTN-JGVFFNPUSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O