John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=I3PAeQlnH4F SpectraBase Spectrum ID=1JoEbaJK1KX

(accessed ).
#15;12-O-ACETYL-PERGULARIN-3-O-BETA-D-OLEANDROPYRANOSYL-(1->4)-BETA-D-DIGITOXYPYRANOSYL-(1->4)-BETA-D-DIGITOXYPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSYL-(1
SpectraBase Compound ID I3PAeQlnH4F
InChI InChI=1S/C70H114O27/c1-32-60(75)47(78-12)27-56(83-32)93-62-34(3)84-53(25-45(62)73)92-61-33(2)85-54(26-46(61)74)94-63-36(5)87-57(29-49(63)80-14)96-65-38(7)89-59(31-51(65)82-16)97-66-37(6)88-58(30-50(66)81-15)95-64-35(4)86-55(28-48(64)79-13)91-42-19-20-67(10)41(23-42)17-18-43-44(67)24-52(90-40(9)72)68(11)69(76,39(8)71)21-22-70(43,68)77/h17,32-38,42-66,73-77H,18-31H2,1-16H3/t32-,33+,34+,35-,36+,37-,38+,42+,43-,44+,45-,46-,47-,48-,49-,50+,51-,52-,53-,54-,55+,56+,57-,58-,59+,60-,61+,62+,63+,64-,65+,66-,67+,68-,69-,70+/m1/s1
InChIKey HEGBNMAHVDMZEY-RYCIRMGHSA-N
Mol Weight 1387.7 g/mol
Molecular Formula C70H114O27
Exact Mass 1386.754749 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 1JoEbaJK1KX
Name #15;12-O-ACETYL-PERGULARIN-3-O-BETA-D-OLEANDROPYRANOSYL-(1->4)-BETA-D-DIGITOXYPYRANOSYL-(1->4)-BETA-D-DIGITOXYPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSYL-(1
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C70H114O27
InChI InChI=1S/C70H114O27/c1-32-60(75)47(78-12)27-56(83-32)93-62-34(3)84-53(25-45(62)73)92-61-33(2)85-54(26-46(61)74)94-63-36(5)87-57(29-49(63)80-14)96-65-38(7)89-59(31-51(65)82-16)97-66-37(6)88-58(30-50(66)81-15)95-64-35(4)86-55(28-48(64)79-13)91-42-19-20-67(10)41(23-42)17-18-43-44(67)24-52(90-40(9)72)68(11)69(76,39(8)71)21-22-70(43,68)77/h17,32-38,42-66,73-77H,18-31H2,1-16H3/t32-,33+,34+,35-,36+,37-,38+,42+,43-,44+,45-,46-,47-,48-,49-,50+,51-,52-,53-,54-,55+,56+,57-,58-,59+,60-,61+,62+,63+,64-,65+,66-,67+,68-,69-,70+/m1/s1
InChIKey HEGBNMAHVDMZEY-RYCIRMGHSA-N
Literature Reference Author T.WARASHINA,T.NORO
Literature Reference Citation CHEM.PHARM.BULL.,46,1752(1998)
Literature Reference DOI 10.1248/cpb.46.1752
Molecular Weight 1387.659 g/mol
Solvent C5D5N
Source File Reference UWMS20839
SpectraBase Batch ID 96ZbIiPAqb4