(3S,4Ar,6Ar,7S,8S,10Ar,10Bs,12As)-7-(2-Carboxyethyl)-8-Isopropenyl-3,7,10A,10B,12A-Pentamethyl-1,2,3,4,4A,6,6A,7,8,9,10,10A,10B,11,12,12A-Hexadecahydro-3-Chrysenecarboxylic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C30H46O4
IUPAC Name (3s,4ar,6ar,7s,8s,10ar,10bs,12as)-7-(2-carboxyethyl)-8-isopropenyl-3,7,10a,10b,12a-pentamethyl-2,4,4a,6,6a,8,9,10,11,12-decahydro-1h-chrysene-3-carboxylic acid
Molecular Mass 470.684 g·mol−1
Heat of Formation -1014.0 ± 16.7 kJ·mol−1
Dipole Moment 3.90 ± 1.08 D
Volume 606.47 Å 3
Surface Area 441.71 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy 3.97 ± eV
Point Group Symmetry C1
InChIKey ASOUKQDZWGOCBR-ICSARBIRSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O