(2alpha,5beta,7beta,10beta,13alpha)-4,10-Diacetoxy-1,7-dihydroxy-13-{[(2R,3S)-2-hydroxy-3-{[(2E)-2-methyl-2-butenoyl]amino}-3-phenylpropanoyl]oxy}-9-oxo-5,20-epoxytax-11-en-2-yl benzoate(CAS: 71610-00-9)
![(2alpha,5beta,7beta,10beta,13alpha)-4,10-Diacetoxy-1,7-dihydroxy-13-{[(2R,3S)-2-hydroxy-3-{[(2E)-2-methyl-2-butenoyl]amino}-3-phenylpropanoyl]oxy}-9-oxo-5,20-epoxytax-11-en-2-yl benzoate (2alpha,5beta,7beta,10beta,13alpha)-4,10-Diacetoxy-1,7-dihydroxy-13-{[(2R,3S)-2-hydroxy-3-{[(2E)-2-methyl-2-butenoyl]amino}-3-phenylpropanoyl]oxy}-9-oxo-5,20-epoxytax-11-en-2-yl benzoate](https://static.chemtradehub.com/structs/716/71610-00-9-048e.webp)
CAS Number
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Other Suppliers for (2alpha,5beta,7beta,10beta,13alpha)-4,10-Diacetoxy-1,7-dihydroxy-13-{[(2R,3S)-2-hydroxy-3-{[(2E)-2-methyl-2-butenoyl]amino}-3-phenylpropanoyl]oxy}-9-oxo-5,20-epoxytax-11-en-2-yl benzoate
Basic Information
Molecular Formula
C45H53NO14
Molecular Weight
831.91 g/mol
Physical State
Powder
Physical Properties
Melting Point
139-141?C
Chemical Identifiers
SMILES
C/C=C(\C)/C(=O)N[C@@H](c1ccccc1)[C@H](C(=O)O[C@H]2C[C@]3([C@H]([C@H]4[C@@]([C@H](C[C@@H]5[C@]4(CO5)OC(=O)C)O)(C(=O)[C@@H](C(=C2C)C3(C)C)OC(=O)C)C)OC(=O)c6ccccc6)O)O
InChIKey
DBXFAPJCZABTDR-WBYYIXQISA-N
Database References
MDL Number
MFCD01075131
FAQ
This compound is a taxane derivative with a complex structure containing multiple hydroxyl, acetoxy, and amino groups. It is characterized by its epoxide rings and aromatic benzoate moiety, making it a potential candidate for pharmaceutical applications. Its molecular formula is C42H58O16, and it is known for its high molecular weight and polar nature.
This compound is primarily used in pharmaceutical research for its potential anti-cancer properties, similar to other taxane derivatives. It may also find applications in drug development, chemical synthesis, and as a reference standard in analytical chemistry. Its unique structural features make it valuable for studying biological activity and mechanism of action.
Safety data for this compound is limited, but as a taxane derivative, it may exhibit toxicity similar to other related compounds. Proper handling, including use of personal protective equipment (PPE), is recommended. It should be used in controlled environments and in accordance with safety guidelines for handling potent chemical substances.
This compound should be stored in a cool, dry, and dark place, preferably at 2-8°C. It is sensitive to moisture and light, so it should be kept in a sealed container with a desiccant. Avoid exposure to air and use airtight packaging to maintain stability and prevent degradation.
Safety Notice
Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.
Always follow proper handling procedures
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