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Search term: JDRNEUMZVBWRJJ (Found by InChIKey (skeleton match))

ChemSpider 2D Image | (1S)-4-O-Acetyl-1,5-anhydro-3,6-dideoxy-3-(dimethylnitroryl)-1-(1-hydroxy-10,12-dimethoxy-6-oxo-8-vinyl-6H-dibenzo[c,h]chromen-4-yl)-D-galactitol | C31H33NO10

(1S)-4-O-Acetyl-1,5-anhydro-3,6-dideoxy-3-(dimethylnitroryl)-1-(1-hydroxy-10,12-dimethoxy-6-oxo-8-vinyl-6H-dibenzo[c,h]chromen-4-yl)-D-galactitol

  • Molecular FormulaC31H33NO10
  • Average mass579.594 Da
  • Monoisotopic mass579.210449 Da
  • ChemSpider ID118142
  • defined stereocentres - 5 of 5 defined stereocentres


More details:






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

(1S)-4-O-Acetyl-1,5-anhydro-3,6-dideoxy-3-(dimethylnitroryl)-1-(1-hydroxy-10,12-dimethoxy-6-oxo-8-vinyl-6H-dibenzo[c,h]chromen-4-yl)-D-galactitol [ACD/IUPAC Name]
(1S)-4-O-Acetyl-1,5-anhydro-3,6-didesoxy-3-(dimethylnitroryl)-1-(1-hydroxy-10,12-dimethoxy-6-oxo-8-vinyl-6H-dibenzo[c,h]chromen-4-yl)-D-galactitol [German] [ACD/IUPAC Name]
(1S)-4-O-Acétyl-1,5-anhydro-3,6-didésoxy-3-(diméthylnitroryl)-1-(1-hydroxy-10,12-diméthoxy-6-oxo-8-vinyl-6H-dibenzo[c,h]chromén-4-yl)-D-galactitol [French] [ACD/IUPAC Name]
D-Galactitol, 1,5-anhydro-3,6-dideoxy-3-(dimethylnitroryl)-1-C-(8-ethenyl-1-hydroxy-10,12-dimethoxy-6-oxo-6H-benzo[d]naphtho[1,2-b]pyran-4-yl)-, 4-acetate, (1S)- [ACD/Index Name]
114494-30-3 [RN]
6H-Benzo(d)naphtho(1,2-b)pyran-6-one, 4-(4-O-acetyl-3,6-dideoxy-3-(dimethylamino)-α-altropyranosyl)-10,12-dimethoxy-8-ethenyl-1-hydroxy-, N-oxide
Deacetylravidomycin N-oxide
Ravidomycin N-oxide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density:
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Index of Refraction:
Molar Refractivity:
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 2.05
ACD/LogD (pH 5.5): 2.21
ACD/BCF (pH 5.5): 28.23
ACD/KOC (pH 5.5): 378.48
ACD/LogD (pH 7.4): 2.18
ACD/BCF (pH 7.4): 26.32
ACD/KOC (pH 7.4): 352.97
Polar Surface Area: 138 Å2
Polarizability:
Surface Tension:
Molar Volume:

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