ChemSpider 2D Image | 2,7-(epoxy[1,11,13]pentadecatrienoimino)naphtho[2,1-b]furan-8-carboxaldehyde, 21-(acetyloxy)-1,2-dihydro-5,6,9,17,19-pentahydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-1,11-dioxo-, 8-[2-[(1E)-1-piperidinylmethylene]hydrazone], (12Z,14E,24E)- | C44H58N4O12

2,7-(epoxy[1,11,13]pentadecatrienoimino)naphtho[2,1-b]furan-8-carboxaldehyde, 21-(acetyloxy)-1,2-dihydro-5,6,9,17,19-pentahydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-1,11-dioxo-, 8-[2-[(1E)-1-piperidinylmethylene]hydrazone], (12Z,14E,24E)-

  • Molecular FormulaC44H58N4O12
  • Average mass834.951 Da
  • Monoisotopic mass834.405151 Da
  • ChemSpider ID21820139

  • Double-bond stereo - Double-bond stereo

More details:

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

(9E,19E,21Z)-2,15,17,27,29-Pentahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-6,23-dioxo-26-{(E)-[(2E)-(1-piperidinylmethylen)hydrazono]methyl}-8,30-dioxa-24-azatetracyclo[23.3.1.14,7.05,28]tr iaconta-1(28),2,4,9,19,21,25(29),26-octaen-13-yl-acetat [German] [ACD/IUPAC Name]
(9E,19E,21Z)-2,15,17,27,29-Pentahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-6,23-dioxo-26-{(E)-[(2E)-(1-piperidinylmethylene)hydrazono]methyl}-8,30-dioxa-24-azatetracyclo[23.3.1.14,7.05,28]t riaconta-1(28),2,4,9,19,21,25(29),26-octaen-13-yl acetate [ACD/IUPAC Name]
(9E,19E,21Z)-2,15,17,27,29-Pentahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-6,23-dioxo-26-{(E)-[(2E)-(piperidin-1-ylmethylene)hydrazono]methyl}-8,30-dioxa-24-azatetracyclo[23.3.1.14,7.05,28]triaconta-1(28),2,4,9,19,21,25(29),26-octaen-13-yl acetate
2,7-(Epoxy[1,11,13]pentadecatrienoimino)naphtho[2,1-b]furan-8-carboxaldehyde, 21-(acetyloxy)-1,2-dihydro-5,6,9,17,19-pentahydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-1,11-dioxo-, 8-[2-[(1E)-1-pi peridinylmethylene]hydrazone], (12Z,14E,24E)- [ACD/Index Name]
2,7-(epoxy[1,11,13]pentadecatrienoimino)naphtho[2,1-b]furan-8-carboxaldehyde, 21-(acetyloxy)-1,2-dihydro-5,6,9,17,19-pentahydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-1,11-dioxo-, 8-[2-[(1E)-1-piperidinylmethylene]hydrazone], (12Z,14E,24E)-
Acétate de (9E,19E,21Z)-2,15,17,27,29-pentahydroxy-11-méthoxy-3,7,12,14,16,18,22-heptaméthyl-6,23-dioxo-26-{(E)-[(2E)-(1-pipéridinylméthylène)hydrazono]méthyl}-8,30-dioxa-24-azatétracyclo[23.3.1.14,7 .05,28]triaconta-1(28),2,4,9,19,21,25(29),26-octaén-13-yle [French] [ACD/IUPAC Name]
(12Z,14E,24E)-5,6,9,17,19-pentahydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-1,11-dioxo-8-{(E)-[(2E)-(piperidin-1-ylmethylidene)hydrazinylidene]methyl}-1,2-dihydro-2,7-(epoxypentadeca[1,11,13]trie
(12Z,14E,24E)-5,6,9,17,19-pentahydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-1,11-dioxo-8-{(E)-[(2E)-(piperidin-1-ylmethylidene)hydrazinylidene]methyl}-1,2-dihydro-2,7-(epoxypentadeca[1,11,13]trienoimino)naphtho[2,1-b]furan-21-yl acetate

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: 1.614
Molar Refractivity: 216.9±0.5 cm3
#H bond acceptors: 16
#H bond donors: 6
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 3
ACD/LogP: 4.02
ACD/LogD (pH 5.5): 2.24
ACD/BCF (pH 5.5): 9.13
ACD/KOC (pH 5.5): 42.17
ACD/LogD (pH 7.4): 1.74
ACD/BCF (pH 7.4): 2.87
ACD/KOC (pH 7.4): 13.27
Polar Surface Area: 229 Å2
Polarizability: 86.0±0.5 10-24cm3
Surface Tension: 48.4±7.0 dyne/cm
Molar Volume: 622.5±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement