2-Propenoic acid,3-phenyl-,(3S,4aR,5S,6S,11R,12R,12aR)-5,11,12-tris(acetyloxy)-1,2,3,4,4a,5,6,7,8,11,12,12a-dodecahydro-6-hydroxy-9,12a,13,13-tetramethyl-4-methylene-8-oxo-6,10-methanobenzocyclodecen-3-yl ester,(2E)

Modify Date: 2025-09-26 18:22:07

2-Propenoic acid,3-phenyl-,(3S,4aR,5S,6S,11R,12R,12aR)-5,11,12-tris(acetyloxy)-1,2,3,4,4a,5,6,7,8,11,12,12a-dodecahydro-6-hydroxy-9,12a,13,13-tetramethyl-4-methylene-8-oxo-6,10-methanobenzocyclodecen-3-yl ester,(2E) Structure
2-Propenoic acid,3-phenyl-,(3S,4aR,5S,6S,11R,12R,12aR)-5,11,12-tris(acetyloxy)-1,2,3,4,4a,5,6,7,8,11,12,12a-dodecahydro-6-hydroxy-9,12a,13,13-tetramethyl-4-methylene-8-oxo-6,10-methanobenzocyclodecen-3-yl ester,(2E) structure
Common Name 2-Propenoic acid,3-phenyl-,(3S,4aR,5S,6S,11R,12R,12aR)-5,11,12-tris(acetyloxy)-1,2,3,4,4a,5,6,7,8,11,12,12a-dodecahydro-6-hydroxy-9,12a,13,13-tetramethyl-4-methylene-8-oxo-6,10-methanobenzocyclodecen-3-yl ester,(2E)
CAS Number 13452-36-3 Molecular Weight 622.70200
Density N/A Boiling Point N/A
Molecular Formula C35H42O10 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 2-Propenoic acid,3-phenyl-,(3S,4aR,5S,6S,11R,12R,12aR)-5,11,12-tris(acetyloxy)-1,2,3,4,4a,5,6,7,8,11,12,12a-dodecahydro-6-hydroxy-9,12a,13,13-tetramethyl-4-methylene-8-oxo-6,10-methanobenzocyclodecen-3-yl ester,(2E)
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C35H42O10
Molecular Weight 622.70200
Exact Mass 622.27800
PSA 142.50000
LogP 4.43940
Vapour Pressure 5.31E-20mmHg at 25°C
InChIKey VBLNERPSGWCFQJ-NINUBRFRSA-N
SMILES C=C1C(OC(=O)C=Cc2ccccc2)CCC2(C)C(OC(C)=O)C(OC(C)=O)C3=C(C)C(=O)CC(O)(C(OC(C)=O)C12)C3(C)C

 Synonyms

o-Cinnamoyltaxicin-i triacetate
1-Hydroxytaxinine
5-Cinnamoyltaxicin I 2,9,10-triacetate
o-Cinnamoyltaxicin-i triacetate [MI]
UNII-90GH5S97P8
Cinnamic acid,5-ester with taxicin I,2,9,10-triacetate
Taxicin I,triacetate,cinnamate
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