2-Debenzoyl Paclitaxel 2-Pentanoate

Base Information

Chemical Name:2-Debenzoyl Paclitaxel 2-Pentanoate
CAS No.:213767-22-7
Molecular Formula:C₄₅H₅₅NO₁₄
Molecular Weight:833.93
Hs Code.:
DSSTox Substance ID:DTXSID40445592
Wikidata:Q82264061
Mol file:213767-22-7.mol

Synonyms:2-Debenzoyl Paclitaxel 2-Pentanoate;213767-22-7;[(1S,2S,3R,4S,7R,9S,10S,12R,15S)-4,12-diacetyloxy-15-[(2R,3S)-3-benzamido-2-hydroxy-3-phenylpropanoyl]oxy-1,9-dihydroxy-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] pentanoate;DTXSID40445592

Suppliers and Price of 2-Debenzoyl Paclitaxel 2-Pentanoate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
2-DebenzoylPaclitaxel2-Pentanoate
2.5mg
$ 150.00

Biosynth Carbosynth
2-Debenzoyl paclitaxel 2-pentanoate
25 mg
$ 1750.00

Biosynth Carbosynth
2-Debenzoyl paclitaxel 2-pentanoate
10 mg
$ 900.00

Biosynth Carbosynth
2-Debenzoyl paclitaxel 2-pentanoate
5 mg
$ 540.00

Biosynth Carbosynth
2-Debenzoyl paclitaxel 2-pentanoate
2 mg
$ 300.00

Biosynth Carbosynth
2-Debenzoyl paclitaxel 2-pentanoate
1 mg
$ 220.00

Total 21 raw suppliers

Chemical Property of 2-Debenzoyl Paclitaxel 2-Pentanoate

Chemical Property:

Boiling Point:923.3±65.0 °C(Predicted)
PKA:11.90±0.20(Predicted)
Density:1.35±0.1 g/cm3(Predicted)
Storage Temp.:-20°C Freezer
Solubility.:Chloroform (Slightly), Methanol (Slightly)
XLogP3:2.2
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:16
Exact Mass:833.36225543
Heavy Atom Count:60
Complexity:1710

Purity/Quality:

99% ^*data from raw suppliers

2-DebenzoylPaclitaxel2-Pentanoate ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCCCC(=O)OC1C2C(C(CC3C2(CO3)OC(=O)C)O)(C(=O)C(C4=C(C(CC1(C4(C)C)O)OC(=O)C(C(C5=CC=CC=C5)NC(=O)C6=CC=CC=C6)O)C)OC(=O)C)C
Isomeric SMILES:CCCCC(=O)O[C@H]1[C@H]2[C@@]([C@H](C[C@@H]3[C@]2(CO3)OC(=O)C)O)(C(=O)[C@@H](C4=C([C@H](C[C@@]1(C4(C)C)O)OC(=O)[C@@H]([C@H](C5=CC=CC=C5)NC(=O)C6=CC=CC=C6)O)C)OC(=O)C)C
Uses Paclitaxel (Taxol) analog. Paclitaxel - In House Impurity.

Technology Process of 2-Debenzoyl Paclitaxel 2-Pentanoate

There total 5 articles about 2-Debenzoyl Paclitaxel 2-Pentanoate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 33069-62-4
taxol

: 213767-22-7
C₄₅H₅₅NO₁₄

Guidance literature:: Multi-step reaction with 5 steps

1: imidazole / dimethylformamide / 2 h / 60 °C

2: imidazole / dimethylformamide / 1 h / Ambient temperature

3: 73 percent / PhCH₂NMe₃OH / CH₂Cl₂ / -78 - -10 °C

4: 1.) DCC, PP / 1.) toluene, RT, 5 min, 2.) toluene

5: HCl, MeOH / Ambient temperature

With 1H-imidazole; hydrogenchloride; methanol; N-benzyl-trimethylammonium hydroxide; dicyclohexyl-carbodiimide; In dichloromethane; N,N-dimethyl-formamide;
DOI:10.1021/jm980229d

Reference yield:

: 114655-02-6
2'-O-(tert-butyldimethylsilyl)paclitaxel

: 213767-22-7
C₄₅H₅₅NO₁₄

Guidance literature:: Multi-step reaction with 4 steps

1: imidazole / dimethylformamide / 1 h / Ambient temperature

2: 73 percent / PhCH₂NMe₃OH / CH₂Cl₂ / -78 - -10 °C

3: 1.) DCC, PP / 1.) toluene, RT, 5 min, 2.) toluene

4: HCl, MeOH / Ambient temperature

With 1H-imidazole; hydrogenchloride; methanol; N-benzyl-trimethylammonium hydroxide; dicyclohexyl-carbodiimide; In dichloromethane; N,N-dimethyl-formamide;
DOI:10.1021/jm980229d

Reference yield:

: 156413-61-5
2'-(tert-butyldimethylsilyl)-7-(triethylsilyl)paclitaxel

: 213767-22-7
C₄₅H₅₅NO₁₄

Guidance literature:: Multi-step reaction with 3 steps

1: 73 percent / PhCH₂NMe₃OH / CH₂Cl₂ / -78 - -10 °C

2: 1.) DCC, PP / 1.) toluene, RT, 5 min, 2.) toluene

3: HCl, MeOH / Ambient temperature

With hydrogenchloride; methanol; N-benzyl-trimethylammonium hydroxide; dicyclohexyl-carbodiimide; In dichloromethane;
DOI:10.1021/jm980229d