55444-68-3

55444-68-3 structure

55444-68-3 structure

Name: (3AR,4R,5R,6AS)-4-((S,E)-3-HYDROXY-5-PHENYLPENT-1-EN-1-YL)-2-OXOHEXAHYDRO-2H-CYCLOPENTA[B]FURAN-5-YL BENZOATE
Chemical Name: [(3aR,4R,5R,6aS)-4-[(3S)-3-hydroxy-5-phenylpent-1-enyl]-2-oxo-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-5-yl] benzoate
CAS Number: 55444-68-3
Molecular Formula: C₂₅H₂₆O₅
Molecular Weight: 406.471
Create Date: 2016-09-22 13:07:42
Modify Date: 2025-08-23 14:58:49

Name	[(3aR,4R,5R,6aS)-4-[(3S)-3-hydroxy-5-phenylpent-1-enyl]-2-oxo-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-5-yl] benzoate
Synonyms	2H-Cyclopenta[b]furan-2-one, 5-(benzoyloxy)hexahydro-4-[(1E,3S)-3-hydroxy-5-phenyl-1-penten-1-yl]-, (3aR,4R,5R,6aS)- (3aR,4R,5R,6aS)-4-[3S-hydroxy-5-phenyl-1E-pentenyl]-5-(benzoyloxy)-hexahydro-2H-cyclopenta[b]furan-2-one (3aR,4R,5R,6aS)-5-(Benzoyloxy)-4-[(E)-(3S)-3-hydroxy-5-phenyl-1-pentenyl]-hexahydro-2H-cyclopenta[b]furan-2-one (3aR,4R,5R,6aS)-4-[(1E,3S)-3-Hydroxy-5-phenyl-1-penten-1-yl]-2-oxohexahydro-2H-cyclopenta[b]furan-5-yl benzoate (3aR,4R,5R,6aS)-4-((S,E)-3-Hydroxy-5-phenylpent-1-en-1-yl)-2-oxohexahydro-2H-cyclopenta[b]furan-5-yl benzoate benzoic acid (3aR,4R,5R,6aS)-4-((E)-(S)-3-hydroxy-5-phenyl-pent-1-enyl)-2-oxo-hexahydro-cyclopenta[b]furan-5-yl ester

Density	1.3±0.1 g/cm3
Boiling Point	609.9±55.0 °C at 760 mmHg
Molecular Formula	C₂₅H₂₆O₅
Molecular Weight	406.471
Flash Point	209.1±25.0 °C
Exact Mass	406.178009
PSA	72.83000
LogP	3.62
Vapour Pressure	0.0±1.8 mmHg at 25°C
Index of Refraction	1.612

55076-60-3 structure

55076-60-3

~%

55444-68-3 structure

55444-68-3

Literature: DeLong, Mitchell A.; Amburgey, Jack; Taylor, Cynthia; Wos, John A.; Soper, David L.; Wang, Yili; Hicks, Renee Bioorganic and Medicinal Chemistry Letters, 2000 , vol. 10, # 14 p. 1519 - 1522

55076-60-3 structure

55076-60-3

~%

55516-35-3 structure

55516-35-3

55444-68-3 structure

55444-68-3

Literature: SANDOZ AG Patent: EP2143712 A1, 2010 ; Location in patent: Page/Page column 54 ;

140-10-3 structure

140-10-3

~%

55444-68-3 structure

55444-68-3

Literature: DeLong, Mitchell A.; Amburgey, Jack; Taylor, Cynthia; Wos, John A.; Soper, David L.; Wang, Yili; Hicks, Renee Bioorganic and Medicinal Chemistry Letters, 2000 , vol. 10, # 14 p. 1519 - 1522

103-25-3 structure

103-25-3

~%

55444-68-3 structure

55444-68-3

Literature: DeLong, Mitchell A.; Amburgey, Jack; Taylor, Cynthia; Wos, John A.; Soper, David L.; Wang, Yili; Hicks, Renee Bioorganic and Medicinal Chemistry Letters, 2000 , vol. 10, # 14 p. 1519 - 1522

41162-19-0 structure

41162-19-0

~%

55444-68-3 structure

55444-68-3

Literature: DeLong, Mitchell A.; Amburgey, Jack; Taylor, Cynthia; Wos, John A.; Soper, David L.; Wang, Yili; Hicks, Renee Bioorganic and Medicinal Chemistry Letters, 2000 , vol. 10, # 14 p. 1519 - 1522

501-52-0 structure

501-52-0

~%

55444-68-3 structure

55444-68-3

Literature: DeLong, Mitchell A.; Amburgey, Jack; Taylor, Cynthia; Wos, John A.; Soper, David L.; Wang, Yili; Hicks, Renee Bioorganic and Medicinal Chemistry Letters, 2000 , vol. 10, # 14 p. 1519 - 1522

Precursor 5
55076-60-3 140-10-3 103-25-3 41162-19-0
501-52-0
DownStream 1
41639-74-1

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