Found 78 results

Search term: MF = 'C_{29}H_{34}O_{8}'
ChemSpider 2D Image | 7'-Acetyl-8a'-hydroxy-7,9'-dimethyl-3'-methylene-6-[(1E)-3-oxo-1-buten-1-yl]-3',3a',4,4',4a',7,8,8a,8a',9',10',10a'-dodecahydro-2'H,3aH-spiro[cyclohepta[b]furan-3,6'-furo[2',3':5,6]cyclohepta[1,2-b]py ran]-2,2'-dione | C29H34O8

7'-Acetyl-8a'-hydroxy-7,9'-dimethyl-3'-methylene-6-[(1E)-3-oxo-1-buten-1-yl]-3',3a',4,4',4a',7,8,8a,8a',9',10',10a'-dodecahydro-2'H,3aH-spiro[cyclohepta[b]furan-3,6'-furo[2',3':5,6]cyclohepta[1,2-b]py ran]-2,2'-dione

  • Molecular FormulaC29H34O8
  • Average mass510.576 Da
  • Monoisotopic mass510.225372 Da
  • ChemSpider ID4747828

  • Double-bond stereo - Double-bond stereo

More details:

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

7'-Acetyl-8a'-hydroxy-7,9'-dimethyl-3'-methylene-6-[(1E)-3-oxo-1-buten-1-yl]-3',3a',4,4',4a',7,8,8a,8a',9',10',10a'-dodecahydro-2'H,3aH-spiro[cyclohepta[b]furan-3,6'-furo[2',3':5,6]cyclohepta[1,2-b]py ran]-2,2'-dione [ACD/IUPAC Name]
Spiro[2H-cyclohepta[b]furan-3(4H),6'(2'H)-furo[2',3':5,6]cyclohepta[1,2-b]pyran]-2,2'-dione, 7'-acetyl-3',3a,3'a,4',4'a,7,8,8a,8'a,9',10',10'a-dodecahydro-8'a-hydroxy-7,9'-dimethyl-3'-methylene-6-[(1E )-3-oxo-1-buten-1-yl]- [ACD/Index Name]
Pungiolide A
Spiro[2H-cyclohepta[b]furan-3(4H),6'(2'H)-furo[2',3':5,6]cyclohepta[1,2-b]pyran]-2,2'-dione, 7'-acetyl-3',3a,3'a,4',4'a,7,8,8a,8'a,9',10',10'a-dodecahydro-8'a-hydroxy-7,9'-dimethyl-3'-methylene-6-[(1E)-3-oxo-1-butenyl]-

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

AIDS138081 [DBID]
AIDS-138081 [DBID]
NSC644193 [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: 769.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.9 mmHg at 25°C
Enthalpy of Vaporization: 127.7±6.0 kJ/mol
Flash Point: 255.5±26.4 °C
Index of Refraction: 1.589
Molar Refractivity: 132.0±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 2.00
ACD/LogD (pH 5.5): 2.24
ACD/BCF (pH 5.5): 29.65
ACD/KOC (pH 5.5): 393.79
ACD/LogD (pH 7.4): 2.24
ACD/BCF (pH 7.4): 29.65
ACD/KOC (pH 7.4): 393.79
Polar Surface Area: 116 Å2
Polarizability: 52.3±0.5 10-24cm3
Surface Tension: 54.1±5.0 dyne/cm
Molar Volume: 391.7±5.0 cm3

Click to predict properties on the Chemicalize site


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