(1R,2R,3S,6S,7R,9S,10S,11S,12R,13S,14R)-2,6,9,11,13,14-Hexahydroxy-7-(Hydroxymethyl)-11-Isopropyl-3,10-Dimethyl-15-Oxapentacyclo[7.5.1.0~1,6~.0~7,13~.0~10,14~]Pentadec-12-Yl 1H-Pyrrole-3-Carboxylate

Molecule SVG Image

Properties Simple | Detailed

Formula C25H35NO10
IUPAC Name (1r,2r,3s,6s,7r,9s,10s,11s,12r,13s,14r)-2,6,9,11,13,14-hexahydroxy-7-(hydroxymethyl)-11-isopropyl-3,10-dimethyl-15-oxapentacyclo[7.5.1.0 1,6 .0 7,13 .0 10,14 ]pentadec-12-yl 1h-pyrrole-3-carboxylate
Molecular Mass 509.546 g·mol−1
Heat of Formation -1882.9 ± 16.7 kJ·mol−1
Dipole Moment 6.38 ± 1.08 D
Volume 554.38 Å 3
Surface Area 397.8 Å 2
HOMO Energy -9.64 ± 0.55 eV
LUMO Energy 2.56 ± eV
Point Group Symmetry C1
InChIKey CAJJMEFYDCCPAX-SFEDZAPPSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N