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2-ALPHA,9-ALPHA,10-BETA-TRIACETOXY-20-HYDROXY-11,12-EPOXYTAXA-4-EN-13-ONE
SpectraBase Compound ID 4it7wcj0ugo
InChI InChI=1S/C26H36O9/c1-13(28)32-20-17-11-18(31)25(7)26(35-25,23(17,4)5)22(34-15(3)30)21(33-14(2)29)24(6)10-8-9-16(12-27)19(20)24/h9,17,19-22,27H,8,10-12H2,1-7H3/t17-,19-,20+,21-,22-,24+,25+,26-/m0/s1
InChIKey CTJYQMYAQQWELR-NGVUTHNNSA-N
Mol Weight 492.6 g/mol
Molecular Formula C26H36O9
Exact Mass 492.235933 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1sFcTwLhSnu
Name 2-ALPHA,9-ALPHA,10-BETA-TRIACETOXY-20-HYDROXY-11,12-EPOXYTAXA-4-EN-13-ONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H36O9
InChI InChI=1S/C26H36O9/c1-13(28)32-20-17-11-18(31)25(7)26(35-25,23(17,4)5)22(34-15(3)30)21(33-14(2)29)24(6)10-8-9-16(12-27)19(20)24/h9,17,19-22,27H,8,10-12H2,1-7H3/t17-,19-,20+,21-,22-,24+,25+,26-/m0/s1
InChIKey CTJYQMYAQQWELR-NGVUTHNNSA-N
Literature Reference Author T.L.PETZKE,Q.W.SHI,F.SAURIOL,O.MAMER,L.O.ZAMIR
Literature Reference Citation J.NAT.PROD.,67,1864(2004)
Literature Reference DOI 10.1021/np049836w
Molecular Weight 492.566 g/mol
Solvent CDCl3
Source File Reference UWMZ6735