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AG00GX77

92950-42-0 | 10-Deacetyl-13-oxobaccatin III

Chemical structure of 10-Deacetyl-13-oxobaccatin III, CAS 92950-42-0
AG00GX77
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CAS Number 92950-42-0
Catalog Number AG00GX77(AGN-PC-0W2H8S)
Chemical Name 10-Deacetyl-13-oxobaccatin III
IUPAC Name [(1S,2S,3R,4S,7R,9S,10S,12R)-4-acetyloxy-1,9,12-trihydroxy-10,14,17,17-tetramethyl-11,15-dioxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate
InChI InChI=1S/C29H34O10/c1-14-17(31)12-29(36)24(38-25(35)16-9-7-6-8-10-16)22-27(5,23(34)21(33)20(14)26(29,3)4)18(32)11-19-28(22,13-37-19)39-15(2)30/h6-10,18-19,21-22,24,32-33,36H,11-13H2,1-5H3/t18-,19+,21+,22-,24-,27+,28-,29+/m0/s1
InChI Key WMZBAMYUOYXRSF-RIFKXWPOSA-N
Molecular Formula C29H34O10
Molecular Weight 542.5743
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)(CC1=O)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)O)C)O
Synonyms
92950-42-0, 10-deacetyl-13-oxobaccatin III, 13-Oxo-10-deacetyl Baccatin III, CHEMBL510651, DTXSID80570271, 10-Deacetyl-13-Oxo-Baccatin III, ZINC42850983, (2aR,4S,4aS,6R,11S,12S,12aR,12bS)-12b-(Acetyloxy)-12-(benzoyloxy)-2a,4,4a,10,11,12,12a,12b-octahydro-4,6,11-trihydroxy-4a,8,13,13-tetramethyl-7,11-methano-1H-cyclodeca[3,4]benz[1,2-b]oxete-5,9(3H,6H)-dione, (5beta,7beta,10beta)-4-(Acetyloxy)-1,7,10-trihydroxy-9,13-dioxo-5,20-epoxytax-11-en-2-yl benzoate, WMZBAMYUOYXRSF-RIFKXWPOSA-N,

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    CERTIFICATE OF ANALYSIS
    Chemical Name: Batch Number:
    Chemical Structure: CAS Registry No:
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    Test: Result:
    Conclusion: The above product meets the specifications of Angene.
    Analyst:Chase
    Date:
    Reviewed by:Jessie
    Date:
    Angene International Limited