Wikidata

(Q420436)

English

docetaxel

chemical compound

  • Docecad®
  • EmDOC
  • Taxotere®
  • Docetaxel
  • TXL
  • N-debenzoyl-N-(tert-butoxycarbonyl)-10-deacetylpaclitaxel
  • N-debenzoyl-N-(tert-butoxycarbonyl)-10-deacetyltaxol
  • docetaxel, anhydrous
  • docetaxel anhydrous
  • Docetaxel anhydrous
  • N-Debenzoyl-N-(tert-butoxycarbonyl)-10-deacetylpaclitaxel
  • N-Debenzoyl-N-(tert-butoxycarbonyl)-10-deacetyltaxol
In more languages

Statements

has use
medication
0 references
mass
807.347 dalton
1 reference
stated in
PubChem
PubChem CID
148124
language of work or name
English
title
docetaxel (English)
retrieved
18 November 2016
chemical formula
C₄₃H₅₃NO₁₄
1 reference
stated in
PubChem
PubChem CID
148124
language of work or name
English
title
docetaxel (English)
retrieved
18 November 2016
canonical SMILES
CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C(C(C5=CC=CC=C5)NC(=O)OC(C)(C)C)O)O)OC(=O)C6=CC=CC=C6)(CO4)OC(=O)C)O)C)O
1 reference
stated in
PubChem
PubChem CID
148124
language of work or name
English
title
docetaxel (English)
retrieved
18 November 2016
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)OC(C)(C)C)O)O)OC(=O)C6=CC=CC=C6)(CO4)OC(=O)C)O)C)O
1 reference
stated in
PubChem
PubChem CID
148124
language of work or name
English
title
docetaxel (English)
retrieved
18 November 2016
legal status (medicine)
boxed warning
1 reference
reference URL
https://nctr-crs.fda.gov/fdalabel/ui/spl-summaries/criteria/343802
title
FDA-sourced list of all drugs with black box warnings (Use Download Full Results and View Query links. (English)
has part(s)
carbon
0 references
nitrogen
0 references
oxygen
0 references
hydrogen
0 references
Commons category
Docetaxel
0 references

Identifiers

Reaxys registry number
4290183
1 reference
stated in
ChEBI
ChEBI ID
4672
language of work or name
English
title
docetaxel anhydrous (English)
retrieved
19 October 2016
HSDB ID
6965
1 reference
stated in
Hazardous Substances Data Bank
HSDB ID
6965
publication date
28 October 2019
title
DOCETAXEL (English)
retrieved
10 May 2021
LiverTox ID
Docetaxel
0 references
EC number
601-339-2
1 reference
stated in
ECHA Substance Infocard database
ECHA Substance Infocard ID
100.129.246
retrieved
27 December 2018
title
(2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-12b-acetoxy-9-(((2R,3S)-3-((tert-butoxycarbonyl)amino)-2-hydroxy-3-phenylpropanoyl)oxy)-4,6,11-trihydroxy-4a,8,13,13-tetramethyl-5-oxo-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-1H-7,11-methanocyclodeca[3,4]benzo[1,2-b]oxet-12-yl (English)
quotation
CAS no.: 114977-28-5 (English)
ECHA Substance Infocard ID
100.129.246
1 reference
stated in
ECHA Substance Infocard database
ECHA Substance Infocard ID
100.129.246
retrieved
27 December 2018
title
(2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-12b-acetoxy-9-(((2R,3S)-3-((tert-butoxycarbonyl)amino)-2-hydroxy-3-phenylpropanoyl)oxy)-4,6,11-trihydroxy-4a,8,13,13-tetramethyl-5-oxo-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-1H-7,11-methanocyclodeca[3,4]benzo[1,2-b]oxet-12-yl (English)
quotation
CAS no.: 114977-28-5 (English)
MeSH concept ID
M0585054
0 references
KEGG ID
C11231
1 reference
stated in
ChEBI
ChEBI ID
4672
language of work or name
English
title
docetaxel anhydrous (English)
retrieved
19 October 2016
D07866
1 reference
stated in
ChEBI
ChEBI ID
4672
language of work or name
English
title
docetaxel anhydrous (English)
retrieved
19 October 2016
PDB ligand ID
TXL
0 references
DeCS ID
57515
0 references
KBpedia ID
Docetaxel
1 reference
stated in
KBpedia
retrieved
9 July 2020
 
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