ChemSpider 2D Image | (10S,12Z,15Z,17Z,19Z,21Z,23R)-23,25-Dihydroxy-10-isopropyl-19-methyl-11-methylene-2,3,10,11,24,24a-hexahydro-5H-3,4a-methanocyclopenta[c][1,3]oxazolo[3,2-e][1,5,14,16]oxatriazacyclohenicosine-8,14(6H, 23H)-dione | C28H35N3O6

(10S,12Z,15Z,17Z,19Z,21Z,23R)-23,25-Dihydroxy-10-isopropyl-19-methyl-11-methylene-2,3,10,11,24,24a-hexahydro-5H-3,4a-methanocyclopenta[c][1,3]oxazolo[3,2-e][1,5,14,16]oxatriazacyclohenicosine-8,14(6H, 23H)-dione

  • Molecular FormulaC28H35N3O6
  • Average mass509.594 Da
  • Monoisotopic mass509.252594 Da
  • ChemSpider ID7863533

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 6 defined stereocentres

More details:

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

(10S,12Z,15Z,17Z,19Z,21Z,23R)-23,25-Dihydroxy-10-isopropyl-19-methyl-11-methylen-2,3,10,11,24,24a-hexahydro-5H-3,4a-methanocyclopenta[c][1,3]oxazolo[3,2-e][1,5,14,16]oxatriazacyclohenicosin-8,14(6H,23 H)-dion [German] [ACD/IUPAC Name]
(10S,12Z,15Z,17Z,19Z,21Z,23R)-23,25-Dihydroxy-10-isopropyl-19-methyl-11-methylene-2,3,10,11,24,24a-hexahydro-5H-3,4a-methanocyclopenta[c][1,3]oxazolo[3,2-e][1,5,14,16]oxatriazacyclohenicosine-8,14(6H, 23H)-dione [ACD/IUPAC Name]
(10S,12Z,15Z,17Z,19Z,21Z,23R)-23,25-Dihydroxy-10-isopropyl-19-méthyl-11-méthylène-2,3,10,11,24,24a-hexahydro-5H-3,4a-méthanocyclopenta[c][1,3]oxazolo[3,2-e][1,5,14,16]oxatriazacyclohénicosine-8,14(6H, 23H)-dione [French] [ACD/IUPAC Name]
5H-3,4a-Methanocyclopent[c]oxazolo[3,2-e][1,5,14,16]oxatriazacycloheneicosine-8,14(6H,23H)-dione, 2,3,10,11,24,24a-hexahydro-23,25-dihydroxy-19-methyl-11-methylene-10-(1-methylethyl)-, (10S,12Z,15Z,17 Z,19Z,21Z,23R)- [ACD/Index Name]
118693-64-4 [RN]
15-Dihydro-13,14-anhydrovirginiamycin M1
L-156,586
Virginiamycin M1, 14,15-didehydro-16-deoxo-14-deoxy-16-hydroxy-, (14E,16S)-

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

L 156586 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 767.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.9 mmHg at 25°C
Enthalpy of Vaporization: 127.4±6.0 kJ/mol
Flash Point: 417.7±35.7 °C
Index of Refraction: 1.617
Molar Refractivity: 137.4±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 1.95
ACD/LogD (pH 5.5): 1.98
ACD/BCF (pH 5.5): 18.29
ACD/KOC (pH 5.5): 268.77
ACD/LogD (pH 7.4): 2.04
ACD/BCF (pH 7.4): 20.73
ACD/KOC (pH 7.4): 304.70
Polar Surface Area: 121 Å2
Polarizability: 54.5±0.5 10-24cm3
Surface Tension: 48.3±7.0 dyne/cm
Molar Volume: 392.9±7.0 cm3

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