N-[(7S)-4-(Hydroxymethyl)-1,2,3,10-Tetramethoxy-9-Oxo-5,6,7,9-Tetrahydrobenzo[A]Heptalen-7-Yl]Acetamide

Molecule SVG Image

Properties Simple | Detailed

Formula C23H27NO7
IUPAC Name n-[(7s)-4-(hydroxymethyl)-1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5h-benzo[a]heptalen-7-yl]acetamide
Molecular Mass 429.463 g·mol−1
Heat of Formation -931.4 ± 16.7 kJ·mol−1
Dipole Moment 5.09 ± 1.08 D
Volume 505.11 Å 3
Surface Area 392.05 Å 2
HOMO Energy -8.78 ± 0.55 eV
LUMO Energy -0.72 ± eV
Point Group Symmetry C1
Synonyms
  • 4-(hydroxymethyl)colchicine
  • 4-hmclc
  • acetamide, n-(5,6,7,9-tetrahydro-4-(hydroxymethyl)-1,2,3,10-tetramethoxy-9-oxobenzo(a)heptalen-7-yl)-, (s)- (9ci)
  • acetamide, n-[5,6,7,9-tetrahydro-4-(hydroxymethyl)-1,2,3,10-tetramethoxy-9-oxobenzo[a]heptalen-7-yl]-, (s)-
  • colchicine, 4-(hydroxymethyl)-
  • colchicine, 4-(hydroxymethyl)- (8ci)
  • n-[(7s)-4-(hydroxymethyl)-1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5h-benzo[d]heptalen-7-yl]acetamide
  • n-[(7s)-4-(hydroxymethyl)-1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5h-benzo[d]heptalen-7-yl]ethanamide
  • n-[(7s)-9-keto-1,2,3,10-tetramethoxy-4-methylol-6,7-dihydro-5h-benzo[d]heptalen-7-yl]acetamide
CAS Number(s)
  • 3986-03-6
InChIKey XOAUTVKFAKCYKZ-KRWDZBQOSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N