Erythromycin C

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Properties Simple | Detailed

Formula C36H65NO13
IUPAC Name (3r,4s,5s,6r,7r,9r,11r,12r,13s,14r)-4-[(2r,4r,5s,6s)-4,5-dihydroxy-4,6-dimethyl-tetrahydropyran-2-yl]oxy-6-[(2s,3r,4s,6r)-4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-14-ethyl-7,12,13-trihydroxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione
Molecular Mass 719.900 g·mol−1
Heat of Formation -2820.9 ± 16.7 kJ·mol−1
Dipole Moment 4.30 ± 1.08 D
Volume 879.35 Å 3
Surface Area 596.58 Å 2
HOMO Energy -8.82 ± 0.55 eV
LUMO Energy 0.62 ± eV
Point Group Symmetry C1
Synonyms
  • (3r,4s,5s,6r,7r,9r,11r,12r,13s,14r)-4-[(2r,4r,5s,6s)-4,5-dihydroxy-4,6-dimethyl-oxan-2-yl]oxy-6-[(2s,3r,4s,6r)-4-dimethylamino-3-hydroxy-6-methyl-oxan-2-yl]oxy-14-ethyl-7,12,13-trihydroxy-3,5,7,9,11,13-hexamethyl-1-oxacyclotetradecane-2,10-dione
  • (3r,4s,5s,6r,7r,9r,11r,12r,13s,14r)-4-[(2r,4r,5s,6s)-4,5-dihydroxy-4,6-dimethyl-tetrahydropyran-2-yl]oxy-6-[(2s,3r,4s,6r)-4-dimethylamino-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-14-ethyl-7,12,13-trihydroxy-3,5,7,9,11,13-hexamethyl-1-oxacyclotetradecane-2,10-dione
  • (3r,4s,5s,6r,7r,9r,11r,12r,13s,14r)-4-[(2r,4r,5s,6s)-4,5-dihydroxy-4,6-dimethyl-tetrahydropyran-2-yl]oxy-6-[(2s,3r,4s,6r)-4-dimethylamino-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-14-ethyl-7,12,13-trihydroxy-3,5,7,9,11,13-hexamethyl-1-oxacyclotetradecane-2,10-quinone
  • (3r,4s,5s,6r,7r,9r,11r,12r,13s,14r)-4-[[(2r,4r,5s,6s)-4,5-dihydroxy-4,6-dimethyl-2-tetrahydropyranyl]oxy]-6-[[(2s,3r,4s,6r)-4-dimethylamino-3-hydroxy-6-methyl-2-tetrahydropyranyl]oxy]-14-ethyl-7,12,13-trihydroxy-3,5,7,9,11,13-hexamethyl-1-oxacyclotetradecane-2,10-dione
  • 3''-o-demethylerythromycin
  • erythromycin, 3''-o-demethyl-
CAS Number(s)
  • 1675-02-1
InChIKey MWFRKHPRXPSWNT-QNPWSHAKSA-N
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