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ARTHROBOTRISIN_B;(1-R',2-S',5-R',6-S')-1-((1-S',2-E',4-S',6-E')-1,4-DIHYDROXY-3,7,11-TRIMETHYLDODECA
SpectraBase Compound ID PFnKWa8tfG
InChI InChI=1S/C22H34O6/c1-13(2)6-5-7-14(3)8-9-17(24)15(4)10-18(25)22-19(26)11-16(12-23)20(27)21(22)28-22/h6,8,10-11,17-21,23-27H,5,7,9,12H2,1-4H3/b14-8+,15-10+/t17-,18-,19-,20+,21-,22+/m0/s1
InChIKey VTOBGWHJIIZDHV-XMCVGHNMSA-N
Mol Weight 394.5 g/mol
Molecular Formula C22H34O6
Exact Mass 394.235539 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EWhIyblqHPM
Name ARTHROBOTRISIN_B;(1-R',2-S',5-R',6-S')-1-((1-S',2-E',4-S',6-E')-1,4-DIHYDROXY-3,7,11-TRIMETHYLDODECA
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H34O6
InChI InChI=1S/C22H34O6/c1-13(2)6-5-7-14(3)8-9-17(24)15(4)10-18(25)22-19(26)11-16(12-23)20(27)21(22)28-22/h6,8,10-11,17-21,23-27H,5,7,9,12H2,1-4H3/b14-8+,15-10+/t17-,18-,19-,20+,21-,22+/m0/s1
InChIKey VTOBGWHJIIZDHV-XMCVGHNMSA-N
Literature Reference Author L.X.WEI,H.X.ZHANG,J.L.TAN,Y.S.CHU,N.LI,H.X.XUE,Y.L.WANG,X.M. NIU,K.Q.ZHANG
Literature Reference Citation J.NAT.PROD.,74,1526(2011)
Literature Reference DOI 10.1021/np200187z
Molecular Weight 394.508 g/mol
Sample ID 38512
Solvent ACETONE-D6