Substance

ID:1823614

Names and Identifiers
IUPAC name
(1S,2S,3R,4S,7R,9S,10S,12R,15S)-4,12-bis(acetyloxy)-1,9-dihydroxy-15-{[(2R,3S)-2-hydroxy-3-phenyl-3-(phenylformamido)propanoyl]oxy}-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.0³,¹⁰.0⁴,⁷]heptadec-13-en-2-yl benzoate
IUPAC Traditional name
(1S,2S,3R,4S,7R,9S,10S,12R,15S)-4,12-bis(acetyloxy)-1,9-dihydroxy-15-{[(2R,3S)-2-hydroxy-3-phenyl-3-(phenylformamido)propanoyl]oxy}-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.0^{3,10}.0^{4,7}]heptadec-13-en-2-yl benzoate
Synonyms
paclitaxel(2aR-(2aalpha,4beta,4abeta,6beta,9alpha(alpha R*,betaS*),11alpha,12alpha,12balpha))-beta-(Benzoylamino)-alpha-hydroxybenzenepropanoic acid 6,12b-bis(acetyloxy)-12-(benzoyloxy)-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-4,11-dihydroxy-4a,8,13,13-tetramethyl-5-oxo-7,11-methano-1H-cyclodeca(3,4)benz(1,2-b)oxet-9-yl ester5beta,20-Epoxy-1,2-alpha,4,7beta,10beta,13alpha-hexahydroxytax-11-en-9-one 4,10-diacetate 2-benzoate 13-ester with (2R,3S)-N-benzoyl-3-phenylisoserinePaclitaxelTAXOLTaxol Ataxol
Registration numbers
PubChem CID
36314
CAS Number
33069-62-4
DrugBank ID
DB01229
Wikipedia Title
Paclitaxel
KEGG ID
C07394
KNApSAcK Database
C00002365
ACToR Database
33069-62-4
CompTox Database
DTXSID9023413
SABIO-RK Database
14410
SureChEMBL Database
SCHEMBL3976
Rhea Database
RHEA:33687
PDBeChem Database
TA1
VirtualMetabolicHuman Database
taxol
Patent number
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Drug Central Database
2,044
BindingDB Database
50001839
KEGG DRUG Database
D00491
Reactom Database
R-HSA-211910
ArrayExpress (Gene Expression Altlas)
E-GEOD-28784E-GEOD-12791
ArrayExpress (Repository of Microarray data)
E-TOXM-9
PubChem SID
26697100
Properties
No Data Available
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Molecule Details
A tetracyclic diterpenoid isolated originally from the bark of the Pacific yew tree, Taxus brevifolia. It is a mitotic inhibitor used in cancer chemotherapy. Note that the use of the former generic name 'taxol' is now limited, as Taxol is a registered trade mark.
Molecular Spectra
No Data Available
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References
No Data Available
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