Corynanthine

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Properties Simple | Detailed

Formula C21H26N2O3
IUPAC Name methyl (1s,13r,15r,18s,19s,20s)-18-hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate
Molecular Mass 354.443 g·mol−1
Heat of Formation -416.7 ± 16.7 kJ·mol−1
Dipole Moment 2.74 ± 1.08 D
Volume 420.41 Å 3
Surface Area 357.99 Å 2
HOMO Energy -8.15 ± 0.55 eV
LUMO Energy 0.14 ± eV
Point Group Symmetry C1
Synonyms
  • 123333-62-0 (hcl)
  • 483-10-3 (free base)
  • bio1_000472
  • bio1_000961
  • bio1_001450
  • bpbio1_000436
  • methyl (16beta,17alpha)-17-hydroxyyohimban-16-carboxylate
  • smp1_000080
  • yohimban-16-carboxylic acid, 17-hydroxy-, methyl ester, (16beta,17alpha)-
  • yohimban-16-carboxylic acid, 17-hydroxy-, methyl ester, (16beta,17alpha)- (9ci)
  • yohimban-16beta-carboxylic acid, 17alpha-hydroxy-, methyl ester (8ci)
CAS Number(s)
  • 483-10-3
InChIKey BLGXFZZNTVWLAY-DKJBZYCGSA-N
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