N-{(3S,4R,5S,9R,10R,13R,14R,17R)-4-Hydroxy-17-[(2R)-1-(4-Isopropylidene-3,4-Dihydro-2H-Pyrrol-5-Yl)-2-Propanyl]-10,13-Dimethyl-2,3,4,5,6,9,10,11,12,13,14,15,16,17-Tetradecahydro-1H-Cyclopenta[A]Phenanthren-3-Yl}Acetamide

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Formula C31H48N2O2
IUPAC Name n-[(3s,4r,5s,9r,10r,13r,14r,17r)-4-hydroxy-10,13-dimethyl-17-[(1r)-1-methyl-2-[4-(1-methylethylidene)-2,3-dihydropyrrol-5-yl]ethyl]-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthren-3-yl]acetamide
Molecular Mass 480.725 g·mol−1
Heat of Formation 1021.1 ± 16.7 kJ·mol−1
Dipole Moment 6.32 ± 1.08 D
Volume 624.07 Å 3
Surface Area 485.25 Å 2
Point Group Symmetry C1
Synonyms
  • acetamide, n-((3beta,4beta,5alpha,20r)-21-(3,4-dihydro-4-(1-methylethylidene)-2h-pyrrol-5-yl)-4-hydroxy-20-methylpregn-7-en-3-yl)-
  • lokysterolamine b
  • n-[(3s,4r,5s,9r,10r,13r,14r,17r)-4-hydroxy-10,13-dimethyl-17-[(2r)-1-(3-propan-2-ylidene-4,5-dihydropyrrol-2-yl)propan-2-yl]-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthren-3-yl]acetamide
  • n-[(3s,4r,5s,9r,10r,13r,14r,17r)-4-hydroxy-10,13-dimethyl-17-[(2r)-1-(3-propan-2-ylidene-4,5-dihydropyrrol-2-yl)propan-2-yl]-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthren-3-yl]ethanamide
  • n-[(3s,4r,5s,9r,10r,13r,14r,17r)-4-hydroxy-17-[(1r)-2-(3-isopropylidene-1-pyrrolin-2-yl)-1-methyl-ethyl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthren-3-yl]acetamide
  • n-[(3s,4r,5s,9r,10r,13r,14r,17r)-4-hydroxy-17-[(1r)-2-(3-isopropylidene-4,5-dihydropyrrol-2-yl)-1-methyl-ethyl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthren-3-yl]acetamide
  • n-[(3s,4r,5s,9r,10r,13r,14r,17r)-4-hydroxy-17-[(1r)-2-(3-isopropylidene-4,5-dihydropyrrol-2-yl)-1-methylethyl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthren-3-yl]acetamide
  • n-acetyl-4beta-hydroxy-epi-plakinamine a
CAS Number(s)
  • 159934-15-3
InChIKey QUNQBOZYERAKAG-HYWVEBSISA-N
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