Formula |
C30H28O7 |
IUPAC Name |
1,7,9,11-tetrahydroxy-13,13-dimethyl-8-oxo-3-pentyl-benzo[a]tetracene-2-carboxylic acid |
Molecular Mass |
500.539 g·mol−1 |
Heat of Formation |
-1165.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.87 ± 1.08 D |
Volume |
564.72 Å 3 |
Surface Area |
474.32 Å 2 |
HOMO Energy |
-8.67 ± 0.55 eV |
LUMO Energy |
1.92 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- benastatin a
- benzo(a)naphthacene-2-carboxylic acid, 8,13-dihydro-13,13-dimethyl-8-oxo-3-pentyl-1,7,9,11-tetrahydroxy-
|
CAS Number(s) |
|
InChIKey |
LKGKHTANQJZVPR-UHFFFAOYSA-N |
QR Code |
Generate QR Code |
Links |
PubChem
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
H
C
O
|
|
|