Found 23 results

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

ChemSpider 2D Image | (1'R,2R,4S,4'S,5S,6S,8'R,10'E,13'R,14'E,16'E,21'R,24'S)-4,21',24'-Trihydroxy-5,22'-dimethyl-11',13'-bis[(~14~C)methyl]-6-[(2E)-4-(~14~C)methyl(~14~C_5_)-2-penten-2-yl](6,11',12',13',14',17',18',24'-~1
4~C_8_)-3,4,5,6-tetrahydro-2'H-spiro[pyran-2,6'-[3,7,19]trioxatetracyclo[15.6.1.1~4,8~.0~20,24~]pentacosa[10,14,16,22]tetraen]-2'-one | C2014C16H52O8

(1'R,2R,4S,4'S,5S,6S,8'R,10'E,13'R,14'E,16'E,21'R,24'S)-4,21',24'-Trihydroxy-5,22'-dimethyl-11',13'-bis[(14C)methyl]-6-[(2E)-4-(14C)methyl(14C5)-2-penten-2-yl](6,11',12',13',14',17',18',24'-1 4C8)-3,4,5,6-tetrahydro-2'H-spiro[pyran-2,6'-[3,7,19]trioxatetracyclo[15.6.1.14,8.020,24]pentacosa[10,14,16,22]tetraen]-2'-one

  • Molecular FormulaC2014C16H52O8
  • Average mass644.674 Da
  • Monoisotopic mass644.418091 Da
  • ChemSpider ID8569860
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 10 of 11 defined stereocentres

    Non-standard isotope - Non-standard isotope


More details:






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

(1'R,2R,4S,4'S,5S,6S,8'R,10'E,13'R,14'E,16'E,21'R,24'S)-4,21',24'-Trihydroxy-5,22'-dimethyl-11',13'-bis[(14C)methyl]-6-[(2E)-4-(14C)methyl(14C5)-2-penten-2-yl](6,11',12',13',14',17',18',24'-1 4C8)-3,4,5,6-tetrahydro-2'H-spiro[pyran-2,6'-[3,7,19]trioxatetracyclo[15.6.1.14,8.020,24]pentacosa[10,14,16,22]tetraen]-2'-one [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.579
Molar Refractivity: 168.7±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: 66.9±0.5 10-24cm3
Surface Tension: 51.4±5.0 dyne/cm
Molar Volume: 507.2±5.0 cm3

Click to predict properties on the Chemicalize site






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