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(11-Z)-1'-(BETA),2'-(BETA)-DIHYDROXY-STEMOFOLINE

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(11-Z)-1'-(BETA),2'-(BETA)-DIHYDROXY-STEMOFOLINE
SpectraBase Compound ID 3jkETtZXqF
InChI InChI=1S/C22H29NO7/c1-5-12(24)19(25)21-13-6-7-23(21)11-8-14(21)29-22(13)15(11)9(2)17(30-22)18-16(27-4)10(3)20(26)28-18/h9,11-15,19,24-25H,5-8H2,1-4H3/b18-17-/t9-,11+,12+,13+,14+,15+,19-,21-,22+/m0/s1
InChIKey USWYAZMZKYTOPO-NWKWXVFJSA-N
Mol Weight 419.47 g/mol
Molecular Formula C22H29NO7
Exact Mass 419.194402 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IXeRZOTMknr
Name (11-Z)-1'-(BETA),2'-(BETA)-DIHYDROXY-STEMOFOLINE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H29NO7
InChI InChI=1S/C22H29NO7/c1-5-12(24)19(25)21-13-6-7-23(21)11-8-14(21)29-22(13)15(11)9(2)17(30-22)18-16(27-4)10(3)20(26)28-18/h9,11-15,19,24-25H,5-8H2,1-4H3/b18-17-/t9-,11+,12+,13+,14+,15+,19-,21-,22+/m0/s1
InChIKey USWYAZMZKYTOPO-NWKWXVFJSA-N
Literature Reference Author K.SASTRARUJI,T.SASTRARUJI,S.G.PYNE,A.T.UNG,A.JATISATIENR,W.L IE
Literature Reference Citation J.NAT.PROD.,73,935(2010)
Literature Reference DOI 10.1021/np100137h
Molecular Weight 419.475 g/mol
Sample ID 35567
Solvent CDCl3