John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=102UV2fdZPr SpectraBase Spectrum ID=2qw3KnQUdE8

(accessed ).
CORYMBOSIN-OCTAACETATE
SpectraBase Compound ID 102UV2fdZPr
InChI InChI=1S/C48H70O21/c1-24(49)58-19-33-37(62-26(3)51)39(64-28(5)53)41(66-30(7)55)43(68-33)60-22-45(9)15-11-16-46(10)35(45)14-17-47-18-32(12-13-36(46)47)48(57,21-47)23-61-44-42(67-31(8)56)40(65-29(6)54)38(63-27(4)52)34(69-44)20-59-25(2)50/h32-44,57H,11-23H2,1-10H3/t32-,33+,34+,35?,36?,37+,38+,39-,40-,41+,42+,43+,44+,45+,46-,47+,48+/m1/s1
InChIKey CWUKQXVBSFQAQF-OOPOKDDJSA-N
Mol Weight 983.1 g/mol
Molecular Formula C48H70O21
Exact Mass 982.44096 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2qw3KnQUdE8
Name CORYMBOSIN-OCTAACETATE
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H70O21
InChI InChI=1S/C48H70O21/c1-24(49)58-19-33-37(62-26(3)51)39(64-28(5)53)41(66-30(7)55)43(68-33)60-22-45(9)15-11-16-46(10)35(45)14-17-47-18-32(12-13-36(46)47)48(57,21-47)23-61-44-42(67-31(8)56)40(65-29(6)54)38(63-27(4)52)34(69-44)20-59-25(2)50/h32-44,57H,11-23H2,1-10H3/t32-,33+,34+,35?,36?,37+,38+,39-,40-,41+,42+,43+,44+,45+,46-,47+,48+/m1/s1
InChIKey CWUKQXVBSFQAQF-OOPOKDDJSA-N
Literature Reference Author F.J.GARCIA,C.PEREZAMADOR,O.Z.COLLERA
Literature Reference Citation J.NAT.PROD.,56,771(1993)
Literature Reference DOI 10.1021/np50095a017
Molecular Weight 983.071 g/mol
Solvent Unknown
Source File Reference UWTS1072
SpectraBase Batch ID 1Tx1L2ptbb8