7-Epi-10-deacetyltaxol

7-Epi-10-deacetyltaxol

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Catalog Number ACM78454178-1
CAS Number 78454-17-8
Synonyms 7-Epi 10-Desacetyl Paclitaxel
IUPAC Name [(1S,2S,3R,4S,7R,9R,10S,12R,15S)-4-Acetyloxy-15-[(2R,3S)-3-benzamido-2-hydroxy-3-phenylpropanoyl]oxy-1,9,12-trihydroxy-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate
Molecular Weight 811.87
Molecular Formula C45H49NO13
Canonical SMILES CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C(C(C5=CC=CC=C5)NC(=O)C6=CC=CC=C6)O)O)OC(=O)C7=CC=CC=C7)(CO4)OC(=O)C)O)C)O
InChI InChI=1S/C45H49NO13/c1-24-29(57-41(54)35(50)33(26-15-9-6-10-16-26)46-39(52)27-17-11-7-12-18-27)22-45(55)38(58-40(53)28-19-13-8-14-20-28)36-43(5,37(51)34(49)32(24)42(45,3)4)30(48)21-31-44(36,23-56-31)59-25(2)47/h6-20,29-31,33-36,38,48-50,55H,21-23H2,1-5H3,(H,46,52)/t29-,30+,31+,33-,34+,35+,36-,38-,43+,44-,45+/m0/s1
InChI Key TYLVGQKNNUHXIP-DIYBZAJCSA-N
Purity 98%+(HPLC)
Appearance White powder
Storage Store at 4 °C, sealed, away from light (valid for 2 years under this condition).
Complexity 1680
Exact Mass 811.32039062
Heavy Atom Count 59
Isomeric SMILES CC1=C2[C@H](C(=O)[C@@]3([C@@H](C[C@@H]4[C@]([C@H]3[C@@H]([C@@](C2(C)C)(C[C@@H]1OC(=O)[C@@H]([C@H](C5=CC=CC=C5)NC(=O)C6=CC=CC=C6)O)O)OC(=O)C7=CC=CC=C7)(CO4)OC(=O)C)O)C)O
Monoisotopic Mass 811.32039062
Topological Polar Surface Area 215Ų
Custom Q&A

What is the chemical name of the compound 7-EPI-10-DEACETYLTAXOL?

The chemical name of the compound 7-EPI-10-DEACETYLTAXOL is 7-Epi-10-deacetyltaxol.

What is the molecular formula of 7-EPI-10-DEACETYLTAXOL?

The molecular formula of 7-EPI-10-DEACETYLTAXOL is C45H49NO13.

What is the molecular weight of 7-EPI-10-DEACETYLTAXOL?

The molecular weight of 7-EPI-10-DEACETYLTAXOL is 811.88.

What are some synonyms of 7-EPI-10-DEACETYLTAXOL?

Some synonyms of 7-EPI-10-DEACETYLTAXOL include Taxuspinanane E, 10-Desacetyl-7-epipaclitaxel, and Paclitaxel Related CoMpound B.

At what temperature does 7-EPI-10-DEACETYLTAXOL melt?

7-EPI-10-DEACETYLTAXOL melts at a temperature range of 163-170°C.

In which solvents is 7-EPI-10-DEACETYLTAXOL soluble?

7-EPI-10-DEACETYLTAXOL is soluble in methanol, ethanol, DMSO, and other organic solvents.

What is the storage temperature recommended for 7-EPI-10-DEACETYLTAXOL?

The recommended storage temperature for 7-EPI-10-DEACETYLTAXOL is -20°C in a freezer under an inert atmosphere.

What are some common uses of 7-EPI-10-DEACETYLTAXOL?

Some common uses of 7-EPI-10-DEACETYLTAXOL include as an impurity in paclitaxel, as a related compound B of paclitaxel, and for potential growth inhibitory activities against human cancer cells.

Where is 7-EPI-10-DEACETYLTAXOL derived from?

7-EPI-10-DEACETYLTAXOL is derived from Taxus chinensis (Pilger) Rehd.

From which source has the compound 7-EPI-10-DEACETYLTAXOL been isolated?

The compound 7-EPI-10-DEACETYLTAXOL has been isolated from Taxus yunnanensis.

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