ChemSpider 2D Image | (3beta,5beta,25S)-Spirostan-3-yl 6-deoxy-alpha-L-mannopyranosyl-(1->4)-[beta-D-glucopyranosyl-(1->2)]-[beta-D-glucopyranosyl-(1->6)]-beta-D-glucopyranoside | C51H84O22

(3β,5β,25S)-Spirostan-3-yl 6-deoxy-α-L-mannopyranosyl-(1->4)-[β-D-glucopyranosyl-(1->2)]-[β-D-glucopyranosyl-(1->6)]-β-D-glucopyranoside

  • Molecular FormulaC51H84O22
  • Average mass1049.199 Da
  • Monoisotopic mass1048.545410 Da
  • ChemSpider ID171356

  • defined stereocentres - 32 of 32 defined stereocentres

More details:

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

(3β,5β,25S)-Spirostan-3-yl 6-deoxy-α-L-mannopyranosyl-(1->4)-[β-D-glucopyranosyl-(1->2)]-[β-D-glucopyranosyl-(1->6)]-β-D-glucopyranoside [ACD/IUPAC Name]
(3β,5β,25S)-Spirostan-3-yl-6-desoxy-α-L-mannopyranosyl-(1->4)-[β-D-glucopyranosyl-(1->2)]-[β-D-glucopyranosyl-(1->6)]-β-D-glucopyranosid [German] [ACD/IUPAC Name]
19057-61-5 [RN]
242-790-1 [EINECS]
6-Désoxy-α-L-mannopyranosyl-(1->4)-[β-D-glucopyranosyl-(1->2)]-[β-D-glucopyranosyl-(1->;6)]-β-D-glucopyranoside de (3β,5β,25S)-spirostan-3-yle [French] [ACD/IUPAC Name]
β-D-Glucopyranoside, (3β,5β,25S)-spirostan-3-yl O-6-deoxy-α-L-mannopyranosyl-(1->4)-O-[β-D-glucopyranosyl-(1->2)]-O-[β-D-glucopyranosyl-(1->6)]- [ACD/Index Name]
(3β,5β,25S)-Spirostann-3-yl-O-6-deoxy-α-L-mannopyranosyl-(1.4)-O-(β-D-glucopyranosyl-(1.2))-O-(β-D-glucopyranosyl-(1.6))-β-D-glucopyranoside
2,6-BIS(3-PHENYLPROP-2-EN-1-YLIDENE)CYCLOHEXANONE
4-19-00-00836 [Beilstein]
4-19-00-00836 (Beilstein Handbook Reference) [Beilstein]
More...

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

7913T95W7U [DBID]
BRN 0078294 [DBID]
C08906 [DBID]
NSC 106552 [DBID]
UNII-7913T95W7U [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.630
Molar Refractivity: 253.0±0.4 cm3
#H bond acceptors: 22
#H bond donors: 12
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: 1.97
ACD/LogD (pH 5.5): 1.08
ACD/BCF (pH 5.5): 3.91
ACD/KOC (pH 5.5): 92.32
ACD/LogD (pH 7.4): 1.08
ACD/BCF (pH 7.4): 3.91
ACD/KOC (pH 7.4): 92.32
Polar Surface Area: 335 Å2
Polarizability: 100.3±0.5 10-24cm3
Surface Tension: 78.3±5.0 dyne/cm
Molar Volume: 711.3±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement