ChemSpider 2D Image | (1S,3S)-3-Amino-3-[(1-~13~C)ethanoyl]-5,12-dihydroxy-6,11-dioxo(6,11-~13~C_2_)-1,2,3,4,6,11-hexahydro-1-tetracenyl 2-deoxy-beta-D-erythro-pentopyranoside | C2213C3H25NO9

(1S,3S)-3-Amino-3-[(1-13C)ethanoyl]-5,12-dihydroxy-6,11-dioxo(6,11-13C2)-1,2,3,4,6,11-hexahydro-1-tetracenyl 2-deoxy-β-D-erythro-pentopyranoside

  • Molecular FormulaC2213C3H25NO9
  • Average mass486.445 Da
  • Monoisotopic mass486.162994 Da
  • ChemSpider ID107441674

  • defined stereocentres - 5 of 5 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(1S,3S)-3-Amino-3-[(1-13C)ethanoyl]-5,12-dihydroxy-6,11-dioxo(6,11-13C2)-1,2,3,4,6,11-hexahydro-1-tetracenyl 2-deoxy-β-D-erythro-pentopyranoside [ACD/IUPAC Name]
(1S,3S)-3-Amino-3-[(1-13C)ethanoyl]-5,12-dihydroxy-6,11-dioxo(6,11-13C2)-1,2,3,4,6,11-hexahydro-1-tetracenyl-2-desoxy-β-D-erythro-pentopyranosid [German] [ACD/IUPAC Name]
2-Désoxy-β-D-érythro-pentopyranoside de (1S,3S)-3-amino-3-[(1-13C)éthanoyl]-5,12-dihydroxy-6,11-dioxo(6,11-13C2)-1,2,3,4,6,11-hexahydro-1-tétracényle [French] [ACD/IUPAC Name]
5,12-Naphthacenedione-5,12-13C2, 9-amino-7-[(2-deoxy-β-D-erythro-pentopyranosyl)oxy]-7,8,9,10-tetrahydro-6,11-dihydroxy-9-(1-oxoethyl-1-13C)-, (7S,9S)- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.720
Molar Refractivity: 119.0±0.4 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 47.2±0.5 10-24cm3
Surface Tension: 95.4±5.0 dyne/cm
Molar Volume: 301.2±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement