4-(acetyloxy)-13alpha-{[(2R,3S)-3-(5,5-dimethyl-2-oxo-1,3-oxazolidin-3-yl)-2-hydroxy-3-phenylpropanoyl]oxy}-1,7beta,10beta-trihydroxy-9-oxo-4alpha,5beta-5,20-epoxytax-11-en-2alpha-yl benzoate (CHEBI:143484)

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CHEBI:143484 - 4-(acetyloxy)-13alpha-{[(2R,3S)-3-(5,5-dimethyl-2-oxo-1,3-oxazolidin-3-yl)-2-hydroxy-3-phenylpropanoyl]oxy}-1,7beta,10beta-trihydroxy-9-oxo-4alpha,5beta-5,20-epoxytax-11-en-2alpha-yl benzoate

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ChEBI ID	CHEBI:143484
ChEBI Name	4-(acetyloxy)-13alpha-{[(2R,3S)-3-(5,5-dimethyl-2-oxo-1,3-oxazolidin-3-yl)-2-hydroxy-3-phenylpropanoyl]oxy}-1,7beta,10beta-trihydroxy-9-oxo-4alpha,5beta-5,20-epoxytax-11-en-2alpha-yl benzoate
Stars
Submitter	mwilliams
Downloads	Molfile

Formula	C43H51NO14
Net Charge	0
Average Mass	805.874
Monoisotopic Mass	805.33096
SMILES	CC(=O)O[C@@]12CO[C@@H]1C[C@H](O)[C@@]1(C)C(=O)[C@H](O)C3=C(C)[C@@H](OC(=O)[C@H](O)[C@H](c4ccccc4)N4CC(C)(C)OC4=O)C[C@@](O)([C@@H](OC(=O)c4ccccc4)[C@H]21)C3(C)C
InChI	InChI=1S/C43H51NO14/c1-22-26(55-37(51)32(48)30(24-14-10-8-11-15-24)44-20-39(3,4)58-38(44)52)19-43(53)35(56-36(50)25-16-12-9-13-17-25)33-41(7,34(49)31(47)29(22)40(43,5)6)27(46)18-28-42(33,21-54-28)57-23(2)45/h8-17,26-28,30-33,35,46-48,53H,18-21H2,1-7H3/t26-,27-,28+,30-,31+,32+,33-,35-,41+,42-,43+/m0/s1
InChIKey	ZGJIDDLCKSIXRG-VCVYQWHSSA-N

ChEBI Ontology

Outgoing Relation(s)
	4-(acetyloxy)-13alpha-{[(2R,3S)-3-(5,5-dimethyl-2-oxo-1,3-oxazolidin-3-yl)-2-hydroxy-3-phenylpropanoyl]oxy}-1,7beta,10beta-trihydroxy-9-oxo-4alpha,5beta-5,20-epoxytax-11-en-2alpha-yl benzoate (CHEBI:143484) is a taxane diterpenoid (CHEBI:50367)