ChemSpider 2D Image | cephalostatin 7 | C54H76N2O11

cephalostatin 7

  • Molecular FormulaC54H76N2O11
  • Average mass929.188 Da
  • Monoisotopic mass928.544922 Da
  • ChemSpider ID8095000

  • defined stereocentres - 23 of 23 defined stereocentres

More details:

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

(1'S,2S,3R,3a'S,4b'R,5S,5''S,6a'S,9a'S,9b'S,11'R,11a'R,11b'S,12'S,13'R,14a'S,15b'R,17a'S,20a'S,20b'S,22'R,22a'R,22b'S)-5-(Hydroxymethyl)-1',5,5'',9a',11a',12',20a',22a'-octamethyl-3'',3a',4,4'',4b',5, 5',5'',6',6'',6a',7',9',9a',9b',10',11',11a',14a',15b',16',17',17a',18',20',20a',20b',21',22',22a'-triacontahydro-3H-dispiro[furan-2,2'-bisfuro[3'',2'':3',4']cyclopenta[1',2':5,6]naphtho[1,2-b:1',2'-i ]phenazine-13',2''-pyran]-3,5'',11',11b',22' [ACD/IUPAC Name]
cephalostatin 7
Dispiro[furan-2(3H),2'(13'H)-bisfuro[3'',2'':3',4']cyclopenta[1',2':5,6]naphtho[1,2-b:1',2'-i]phenazine-13',2''-[2H]pyran]-3,5'',11',11'b,22',22'b(1'H,12'H)-hexol, 3'',3'a,4,4'',4'b,5,5',5'',6',6'',6' a,7',9',9'a,9'b,10',11',11'a,14'a,15'b,16',17',17'a,18',20',20'a,20'b,21',22',22'a-triacontahydro-5-(hydroxymethyl)-1',5,5'',9'a,11'a,12',20'a,22'a-octamethyl-, (1'S,2S,3R,3a'S,4b'R,5S,5''S,6a'S,9a'S, 9b'S,11'R,11a'R,11b'S,12'S,13'R,14a'S,15b'R, [ACD/Index Name]
138605-82-0 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.671
Molar Refractivity: 246.2±0.4 cm3
#H bond acceptors: 13
#H bond donors: 7
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 4
ACD/LogP: 6.33
ACD/LogD (pH 5.5): 5.99
ACD/BCF (pH 5.5): 21005.95
ACD/KOC (pH 5.5): 43160.22
ACD/LogD (pH 7.4): 5.99
ACD/BCF (pH 7.4): 21032.26
ACD/KOC (pH 7.4): 43214.33
Polar Surface Area: 204 Å2
Polarizability: 97.6±0.5 10-24cm3
Surface Tension: 75.8±5.0 dyne/cm
Molar Volume: 658.7±5.0 cm3

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