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78432-77-6,MFCD01075780
Catalog No.:AA008MQD

78432-77-6 | Deacetyltaxol

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Purity
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Price(USD)
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5mg
≥98%
in stock  
$70.00   $49.00
- +
10mg
≥98%
in stock  
$125.00   $87.00
- +
25mg
≥98%
in stock  
$256.00   $179.00
- +
50mg
≥98%
in stock  
$376.00   $263.00
- +
  • Technical Information
  • Properties
  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA008MQD
Chemical Name:
Deacetyltaxol
CAS Number:
78432-77-6
Molecular Formula:
C45H49NO13
Molecular Weight:
811.8695
MDL Number:
MFCD01075780
SMILES:
CC(=O)O[C@@]12CO[C@@H]1C[C@@H]([C@@]1([C@@H]2[C@H](OC(=O)c2ccccc2)[C@]2(O)C[C@H](OC(=O)[C@@H]([C@H](c3ccccc3)NC(=O)c3ccccc3)O)C(=C(C2(C)C)[C@H](C1=O)O)C)C)O
Properties
Computed Properties
 
Complexity:
1680  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
11  
Heavy Atom Count:
59  
Hydrogen Bond Acceptor Count:
13  
Hydrogen Bond Donor Count:
5  
Rotatable Bond Count:
12  
XLogP3:
1.9  

Literature

Title: Fatal poisoning with Taxus baccata: quantification of paclitaxel (taxol A), 10-deacetyltaxol, baccatin III, 10-deacetylbaccatin III, cephalomannine (taxol B), and 3,5-dimethoxyphenol in body fluids by liquid chromatography-tandem mass spectrometry.

Journal: Journal of analytical toxicology 20120101

Title: Single-site chemical modification at C10 of the baccatin III core of paclitaxel and Taxol C reduces P-glycoprotein interactions in bovine brain microvessel endothelial cells.

Journal: Bioorganic & medicinal chemistry letters 20060201

Title: 19-Hydroxybaccatin III, 10-deacetylcephalomannine, and 10-deacetyltaxol: new antitumor taxanes from Taxus wallichiana. J Nat Prod. 1981 May-Jun;44(3):312-9.

Title: Michel Colin, et al. Process for the preparation of taxol and 10-deacetyltaxol. US4857653A.

Title: Helson L. Cephalomannine and 10-deacetyltaxol cytotoxicity in human glial and neuroblastoma cell-lines. Int J Oncol. 1993 Feb;2(2):297-9.

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SDS
Tags:78432-77-6 Molecular Formula|78432-77-6 MDL|78432-77-6 SMILES|78432-77-6 Deacetyltaxol