ChemSpider 2D Image | 3-O-(alpha-L-olivosyl)erythronolide B | C27H48O10

3-O-(α-L-olivosyl)erythronolide B

  • Molecular FormulaC27H48O10
  • Average mass532.664 Da
  • Monoisotopic mass532.324768 Da
  • ChemSpider ID26333077

  • defined stereocentres - 14 of 14 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(3R,4S,5R,6R,7R,9R,11R,12S,13R,14R)-4-{[(2R,4S,5R,6S)-4,5-Dihydroxy-6-methyltetrahydro-2H-pyran-2-yl]oxy}-14-ethyl-6,7,12-trihydroxy-3,5,7,9,11,13-hexamethyloxacyclotetradecan-2,10-dion (non-preferred name) [German] [ACD/IUPAC Name]
(3R,4S,5R,6R,7R,9R,11R,12S,13R,14R)-4-{[(2R,4S,5R,6S)-4,5-Dihydroxy-6-methyltetrahydro-2H-pyran-2-yl]oxy}-14-ethyl-6,7,12-trihydroxy-3,5,7,9,11,13-hexamethyloxacyclotetradecane-2,10-dione (non-preferr ed name) [ACD/IUPAC Name]
(3R,4S,5R,6R,7R,9R,11R,12S,13R,14R)-4-{[(2R,4S,5R,6S)-4,5-Dihydroxy-6-méthyltétrahydro-2H-pyran-2-yl]oxy}-14-éthyl-6,7,12-trihydroxy-3,5,7,9,11,13-hexaméthyloxacyclotétradécane-2,10-dione (non-preferr ed name) [French] [ACD/IUPAC Name]
3-O-(α-L-olivosyl)erythronolide B
(3R,4S,5R,6R,7R,9R,11R,12S,13R,14R)-14-ethyl-4,6,7,12-tetrahydroxy-3,5,7,9,11,13-hexamethyl-2,10-dioxooxacyclotetradecan-4-yl 2,6-dideoxy-α-Larabino-hexopyranoside
(3R,4S,5R,6R,7R,9R,11R,12S,13R,14R)-14-ethyl-4,6,7,12-tetrahydroxy-3,5,7,9,11,13-hexamethyloxacyclotetradecane-2,10-dione-4-yl 2,6-dideoxy-α-Larabino-hexopyranoside
(3R,4S,5R,6R,7R,9R,11R,12S,13R,14R)-4-{[(2R,4S,5R,6S)-4,5-dihydroxy-6-methyltetrahydro-2H-pyran-2-yl]oxy}-14-ethyl-6,7,12-trihydroxy-3,5,7,9,11,13-hexamethyloxacyclotetradecane-2,10-dione
3-L-olivosyl-erythronolide B
4-L-olivosyl-erythronolide B
4-O-(α-L-olivosyl)erythronolide B
More...

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CHEBI:63288 [DBID]
  • Miscellaneous

    • Chemical Class:

      A macrolide that is erythronolide B having a 2,6-dideoxy-<stereo>alpha</stereo>-<stereo>L</stereo>-<stereo>arabino</stereo>-hexopyranosyl (<stereo>alpha</stereo>-<stereo>L</stereo>-olivosyl) residue a ttached at position 3. ChEBI CHEBI:63288
      A macrolide that is erythronolide B having a 2,6-dideoxy-alpha-L-arabino-hexopyranosyl (alpha-L-olivosyl) residue a; ttached at position 3. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:63288
      A macrolide that is erythronolide B having a 2,6-dideoxy-alpha-L-arabino-hexopyranosyl (alpha-L-olivosyl) residue attached at position 3. ChEBI CHEBI:63288

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 696.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.0 mmHg at 25°C
Enthalpy of Vaporization: 116.6±6.0 kJ/mol
Flash Point: 221.1±25.0 °C
Index of Refraction: 1.530
Molar Refractivity: 135.8±0.4 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 3
ACD/LogP: 1.31
ACD/LogD (pH 5.5): 1.54
ACD/BCF (pH 5.5): 8.66
ACD/KOC (pH 5.5): 163.19
ACD/LogD (pH 7.4): 1.54
ACD/BCF (pH 7.4): 8.66
ACD/KOC (pH 7.4): 163.19
Polar Surface Area: 163 Å2
Polarizability: 53.8±0.5 10-24cm3
Surface Tension: 51.7±5.0 dyne/cm
Molar Volume: 439.7±5.0 cm3

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