(1α,5Xi,10Xi,14α,16Beta)-20-Ethyl-8,9-Dihydroxy-1,14,16-Trimethoxyaconitan-4-Yl 2-Aminobenzoate

Molecule SVG Image

Properties Simple | Detailed

Formula C30H28N2O7
IUPAC Name (1alpha,5xi,10xi,14alpha,16beta)-20-ethyl-8,9-dihydroxy-1,14,16-trimethoxyaconitan-4-yl 2-aminobenzoate
Molecular Mass 528.553 g·mol−1
Heat of Formation 3557.8 ± 16.7 kJ·mol−1
Dipole Moment 4.81 ± 1.08 D
Volume 591.5 Å 3
Surface Area 422.78 Å 2
HOMO Energy -8.64 ± 0.55 eV
LUMO Energy -1.76 ± eV
Point Group Symmetry C1
InChIKey VSUODASNSRJNCP-UVBUGMJOSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C O N