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PENDOLMYCIN
SpectraBase Compound ID 2ayAOzyuOdT
InChI InChI=1S/C22H31N3O2/c1-7-22(4,5)16-8-9-17-18-14(11-23-19(16)18)10-15(12-26)24-21(27)20(13(2)3)25(17)6/h7-9,11,13,15,20,23,26H,1,10,12H2,2-6H3,(H,24,27)/t15-,20-/m0/s1
InChIKey JPJWIAYMFHOJRY-YWZLYKJASA-N
Mol Weight 369.51 g/mol
Molecular Formula C22H31N3O2
Exact Mass 369.241627 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AbCaK575roy
Name PENDOLMYCIN
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H31N3O2
InChI InChI=1S/C22H31N3O2/c1-7-22(4,5)16-8-9-17-18-14(11-23-19(16)18)10-15(12-26)24-21(27)20(13(2)3)25(17)6/h7-9,11,13,15,20,23,26H,1,10,12H2,2-6H3,(H,24,27)/t15-,20-/m0/s1
InChIKey JPJWIAYMFHOJRY-YWZLYKJASA-N
Literature Reference Author H.HUANG,Y.YAO,Z.HE,T.YANG,J.MA,X.TIAN,Y.LI,C.HUANG,X.CHEN,W. LI,S.ZHANG,C.ZHANG,J
Literature Reference Citation J.NAT.PROD.,74,2122(2011)
Literature Reference DOI 10.1021/np200399t
Molecular Weight 369.507 g/mol
Sample ID 39362
Solvent CD3OD