12-(benzoyloxy)-9-((3-((tert-butoxy(hydroxy)methylene)amino)-2-hydroxy-4,4-dimethylpentanoyl)oxy)-4,11-dihydroxy-4a,8,13,13-tetramethyl-5-oxo-3,4,4a,5,6,9,10,11,12,12a-decahydro-1H-7,11-methanocyclodeca[3,4]benzo[1,2-b]oxete-6,12b(2aH)-diyl diacetate

Modify Date: 2025-09-18 15:46:50

12-(benzoyloxy)-9-((3-((tert-butoxy(hydroxy)methylene)amino)-2-hydroxy-4,4-dimethylpentanoyl)oxy)-4,11-dihydroxy-4a,8,13,13-tetramethyl-5-oxo-3,4,4a,5,6,9,10,11,12,12a-decahydro-1H-7,11-methanocyclodeca[3,4]benzo[1,2-b]oxete-6,12b(2aH)-diyl diacetate Structure
12-(benzoyloxy)-9-((3-((tert-butoxy(hydroxy)methylene)amino)-2-hydroxy-4,4-dimethylpentanoyl)oxy)-4,11-dihydroxy-4a,8,13,13-tetramethyl-5-oxo-3,4,4a,5,6,9,10,11,12,12a-decahydro-1H-7,11-methanocyclodeca[3,4]benzo[1,2-b]oxete-6,12b(2aH)-diyl diacetate structure
Common Name 12-(benzoyloxy)-9-((3-((tert-butoxy(hydroxy)methylene)amino)-2-hydroxy-4,4-dimethylpentanoyl)oxy)-4,11-dihydroxy-4a,8,13,13-tetramethyl-5-oxo-3,4,4a,5,6,9,10,11,12,12a-decahydro-1H-7,11-methanocyclodeca[3,4]benzo[1,2-b]oxete-6,12b(2aH)-diyl diacetate
CAS Number 406911-32-8 Molecular Weight 829.926
Density 1.3±0.1 g/cm3 Boiling Point 866.2±65.0 °C at 760 mmHg
Molecular Formula C43H59NO15 Melting Point N/A
MSDS N/A Flash Point 477.7±34.3 °C

 Names

Name 12-(benzoyloxy)-9-((3-((tert-butoxy(hydroxy)methylene)amino)-2-hydroxy-4,4-dimethylpentanoyl)oxy)-4,11-dihydroxy-4a,8,13,13-tetramethyl-5-oxo-3,4,4a,5,6,9,10,11,12,12a-decahydro-1H-7,11-methanocyclodeca[3,4]benzo[1,2-b]oxete-6,12b(2aH)-diyl diacetate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.3±0.1 g/cm3
Boiling Point 866.2±65.0 °C at 760 mmHg
Molecular Formula C43H59NO15
Molecular Weight 829.926
Flash Point 477.7±34.3 °C
Exact Mass 829.388489
PSA 234.01000
LogP 6.86
Vapour Pressure 0.0±0.3 mmHg at 25°C
Index of Refraction 1.577
InChIKey QEWXHTLVNBRNDU-VQQGRJEZSA-N
SMILES CC(=O)OC1C(=O)C2(C)C(O)CC3OCC3(OC(C)=O)C2C(OC(=O)c2ccccc2)C2(O)CC(OC(=O)C(O)C(NC(=O)OC(C)(C)C)C(C)(C)C)C(C)=C1C2(C)C

 Synonyms

(1S,2S,3R,4S,7R,9S,10S,12R,15S)-4,12-Diacetoxy-1,9-dihydroxy-15-{[(2R,3S)-2-hydroxy-4,4-dimethyl-3-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)pentanoyl]oxy}-10,14,17,17-tetramethyl-11-oxo-6-oxatetracy ;clo[11.3.1.0.0]heptadec-13-en-2-yl benzoate
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