Found 33 results

Search term: MF = 'C_{38}H_{47}NO_{6}'
ChemSpider 2D Image | (1S,4R,5S,16R,17S,23S,26S,30R)-17,26-Dihydroxy-4,5,13,13,15,15,23,31,31-nonamethyl-14,32,33-trioxa-7-azanonacyclo[28.2.1.0~1,27~.0~4,26~.0~5,23~.0~6,21~.0~8,20~.0~10,18~.0~11,16~]tritriaconta-6(21),8( 20),9,11,18,27-hexaen-29-one | C38H47NO6

(1S,4R,5S,16R,17S,23S,26S,30R)-17,26-Dihydroxy-4,5,13,13,15,15,23,31,31-nonamethyl-14,32,33-trioxa-7-azanonacyclo[28.2.1.01,27.04,26.05,23.06,21.08,20.010,18.011,16]tritriaconta-6(21),8( 20),9,11,18,27-hexaen-29-one

  • Molecular FormulaC38H47NO6
  • Average mass613.783 Da
  • Monoisotopic mass613.340332 Da
  • ChemSpider ID76802858

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(1S,4R,5S,16R,17S,23S,26S,30R)-17,26-Dihydroxy-4,5,13,13,15,15,23,31,31-nonamethyl-14,32,33-trioxa-7-azanonacyclo[28.2.1.01,27.04,26.05,23.06,21.08,20.010,18.011,16]tritriaconta-6(21),8( 20),9,11,18,27-hexaen-29-on [German] [ACD/IUPAC Name]
(1S,4R,5S,16R,17S,23S,26S,30R)-17,26-Dihydroxy-4,5,13,13,15,15,23,31,31-nonamethyl-14,32,33-trioxa-7-azanonacyclo[28.2.1.01,27.04,26.05,23.06,21.08,20.010,18.011,16]tritriaconta-6(21),8( 20),9,11,18,27-hexaen-29-one [ACD/IUPAC Name]
(1S,4R,5S,16R,17S,23S,26S,30R)-17,26-Dihydroxy-4,5,13,13,15,15,23,31,31-nonaméthyl-14,32,33-trioxa-7-azanonacyclo[28.2.1.01,27.04,26.05,23.06,21.08,20.010,18.011,16]tritriaconta-6(21),8( 20),9,11,18,27-hexaén-29-one [French] [ACD/IUPAC Name]
4H-3,18a-Epoxy-1-benzoxepino[6',7':6,7]indeno[1,2-b]pyrano[4',3':3,4]cyclopent[1,2-f]indol-4-one, 2,3,5b,6,7,7a,8,10,10a,11,13,16,16b,16c,17,18-hexadecahydro-5b,10-dihydroxy-2,2,7a,11,11,13,13,16b,16c -nonamethyl-, (3R,5bS,7aS,10S,10aR,16bS,16cR,18aS)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.668
Molar Refractivity: 170.6±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 2
ACD/LogP: 6.59
ACD/LogD (pH 5.5): 6.18
ACD/BCF (pH 5.5): 29304.49
ACD/KOC (pH 5.5): 54829.72
ACD/LogD (pH 7.4): 6.18
ACD/BCF (pH 7.4): 29304.49
ACD/KOC (pH 7.4): 54829.72
Polar Surface Area: 101 Å2
Polarizability: 67.6±0.5 10-24cm3
Surface Tension: 63.5±5.0 dyne/cm
Molar Volume: 457.8±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement