ChemSpider 2D Image | Mannioside A | C39H62O13

Mannioside A

  • Molecular FormulaC39H62O13
  • Average mass738.902 Da
  • Monoisotopic mass738.419067 Da
  • ChemSpider ID25036053

  • defined stereocentres - 21 of 21 defined stereocentres

More details:

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

(3β,25R)-17-Hydroxyspirost-5-en-3-yl 3-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside [ACD/IUPAC Name]
(3β,25R)-17-Hydroxyspirost-5-en-3-yl-3-O-(6-desoxy-α-L-mannopyranosyl)-β-D-glucopyranosid [German] [ACD/IUPAC Name]
3-O-(6-Désoxy-α-L-mannopyranosyl)-β-D-glucopyranoside de (3β,25R)-17-hydroxyspirost-5-én-3-yle [French] [ACD/IUPAC Name]
Mannioside A
β-D-Glucopyranoside, (3β,25R)-17-hydroxyspirost-5-en-3-yl 3-O-(6-deoxy-α-L-mannopyranosyl)- [ACD/Index Name]
[1038922-95-0] [RN]
103892-29-1 [RN]
1038922-95-0 [RN]
3β,17α-dihydroxyspirost-5-ene-3-O-α-L-rhamnopyranosyl-(1->3)-β-D-glucopyranoside
MANIOSIDE A
More...
  • Miscellaneous

    • Chemical Class:

      A steroid saponin that consists of pennogenin attached to <stereo>alpha</stereo>-<stereo>L</stereo>-rhamnopyranosyl-(1<arrow>right</arrow>3)-<stereo>beta</stereo>-<stereo>D</stereo>-glucopyranosyl res idue at position 3 via a glycoidic linkage. Isolated from <ital>Dracaena mannii</ital>, it exhibits anti-inflammatory activity. ChEBI CHEBI:66665
      A steroid saponin that consists of pennogenin attached to alpha-L-rhamnopyranosyl-(1->3)-beta-D-glucopyranosyl residue at position 3 via a glycoidic linkage. Isolated from Dracaena mannii, it exhibits anti-inflammatory activity. ChEBI CHEBI:66665
      A steroid saponin that consists of pennogenin attached to alpha-L-rhamnopyranosyl-(1right3)-beta-D-glucopyranosyl res; idue at position 3 via a glycoidic linkage. Isolated from Dracaena mannii, it exh ibits anti-inflammatory activity. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:66665

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

Density: 1.4±0.1 g/cm3
Boiling Point: 881.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 145.6±6.0 kJ/mol
Flash Point: 487.0±34.3 °C
Index of Refraction: 1.616
Molar Refractivity: 186.8±0.4 cm3
#H bond acceptors: 13
#H bond donors: 7
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 4
ACD/LogP: 5.89
ACD/LogD (pH 5.5): 4.55
ACD/BCF (pH 5.5): 1690.06
ACD/KOC (pH 5.5): 7114.27
ACD/LogD (pH 7.4): 4.55
ACD/BCF (pH 7.4): 1690.04
ACD/KOC (pH 7.4): 7114.18
Polar Surface Area: 197 Å2
Polarizability: 74.1±0.5 10-24cm3
Surface Tension: 67.4±5.0 dyne/cm
Molar Volume: 534.8±5.0 cm3

Click to predict properties on the Chemicalize site


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