ChemSpider 2D Image | (1S)-3-Glycoloyl-5,12-dihydroxy-10-methoxy-6,11-dioxo-1,2,6,11-tetrahydro-1-tetracenyl 3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranoside | C27H27NO10

(1S)-3-Glycoloyl-5,12-dihydroxy-10-methoxy-6,11-dioxo-1,2,6,11-tetrahydro-1-tetracenyl 3-amino-2,3,6-trideoxy-α-L-lyxo-hexopyranoside

  • Molecular FormulaC27H27NO10
  • Average mass525.504 Da
  • Monoisotopic mass525.163513 Da
  • ChemSpider ID170288

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(1S)-3-Glycoloyl-5,12-dihydroxy-10-methoxy-6,11-dioxo-1,2,6,11-tetrahydro-1-tetracenyl 3-amino-2,3,6-trideoxy-α-L-lyxo-hexopyranoside [ACD/IUPAC Name]
(1S)-3-Glycoloyl-5,12-dihydroxy-10-methoxy-6,11-dioxo-1,2,6,11-tetrahydro-1-tetracenyl-3-amino-2,3,6-tridesoxy-α-L-lyxo-hexopyranosid [German] [ACD/IUPAC Name]
3-Amino-2,3,6-tridésoxy-α-L-lyxo-hexopyranoside de (1S)-5,12-dihydroxy-3-(2-hydroxyacétyl)-10-méthoxy-6,11-dioxo-1,2,6,11-tétrahydro-1-tétracényle [French] [ACD/IUPAC Name]
5,12-Naphthacenedione, 10-((3-amino-2,3,6-trideoxy-α-L-lyxo-hexopyranosyl)oxy)-9,10-dihydro-6,11-dihydroxy-8-(hydroxyacetyl)-1-methoxy-, (S)-
5,12-Naphthacenedione, 10-[(3-amino-2,3,6-trideoxy-α-L-lyxo-hexopyranosyl)oxy]-9,10-dihydro-6,11-dihydroxy-8-(2-hydroxyacetyl)-1-methoxy-, (10S)- [ACD/Index Name]
(10S)-10-{[(2R,4S,5S,6S)-4-AMINO-5-HYDROXY-6-METHYLOXAN-2-YL]OXY}-6,11-DIHYDROXY-8-(2-HYDROXYACETYL)-1-METHOXY-9,10-DIHYDROTETRACENE-5,12-DIONE
(7S)-7-{[(2R,4S,5S,6S)-4-AMINO-5-HYDROXY-6-METHYLOXAN-2-YL]OXY}-6,11-DIHYDROXY-9-(2-HYDROXYACETYL)-4-METHOXY-5,7,8,12-TETRAHYDROTETRACENE-5,12-DIONE
80996-23-2 [RN]
9,10-Anhydro Doxorubicin
9,10-Anhydroadriamycin
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.6±0.1 g/cm3
Boiling Point: 788.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 120.3±3.0 kJ/mol
Flash Point: 430.8±32.9 °C
Index of Refraction: 1.709
Molar Refractivity: 129.7±0.4 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 3
ACD/LogP: 4.39
ACD/LogD (pH 5.5): -0.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.32
ACD/LogD (pH 7.4): 0.44
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.69
Polar Surface Area: 186 Å2
Polarizability: 51.4±0.5 10-24cm3
Surface Tension: 90.8±5.0 dyne/cm
Molar Volume: 332.2±5.0 cm3

Click to predict properties on the Chemicalize site


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