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LNTGIIOHABLYMJ-RVWSAAQRSA-N
SpectraBase Compound ID 6a4z3rw2Vi0
InChI InChI=1S/C48H80O18/c1-23(2)9-8-15-47(7,66-42-39(60)36(57)33(54)27(20-50)62-42)25-12-16-45(5)24(25)10-11-30-46(45,6)17-13-29-44(3,4)31(14-18-48(29,30)22-52)64-43-40(37(58)34(55)28(21-51)63-43)65-41-38(59)35(56)32(53)26(19-49)61-41/h9,22,24-43,49-51,53-60H,8,10-21H2,1-7H3/t24?,25-,26+,27+,28+,29?,30?,31-,32+,33+,34+,35-,36-,37-,38+,39+,40+,41-,42-,43-,45+,46+,47-,48+/m0/s1
InChIKey LNTGIIOHABLYMJ-RVWSAAQRSA-N
Mol Weight 945.1 g/mol
Molecular Formula C48H80O18
Exact Mass 944.534466 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FZ5oUqyZJgj
Name LNTGIIOHABLYMJ-RVWSAAQRSA-N
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H80O18
InChI InChI=1S/C48H80O18/c1-23(2)9-8-15-47(7,66-42-39(60)36(57)33(54)27(20-50)62-42)25-12-16-45(5)24(25)10-11-30-46(45,6)17-13-29-44(3,4)31(14-18-48(29,30)22-52)64-43-40(37(58)34(55)28(21-51)63-43)65-41-38(59)35(56)32(53)26(19-49)61-41/h9,22,24-43,49-51,53-60H,8,10-21H2,1-7H3/t24?,25-,26+,27+,28+,29?,30?,31-,32+,33+,34+,35-,36-,37-,38+,39+,40+,41-,42-,43-,45+,46+,47-,48+/m0/s1
InChIKey LNTGIIOHABLYMJ-RVWSAAQRSA-N
Literature Reference Author L.HU,Z.CHEN,Y.XIE
Literature Reference Citation J.NAT.PROD.,59,1143(1996)
Literature Reference DOI 10.1021/np960445u
Molecular Weight 945.152 g/mol
Solvent C5D5N
Source File Reference UWKP67