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15-BETA-HYDROXYLINEOLON-3-O-BETA-D-OLEANDROPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSYL-(1->4)-BETA-D-OLEANDROPYRANOSYL-(1->4)-BETA-D-OLEANDROPY
SpectraBase Compound ID GXWmtT0AAQy
InChI InChI=1S/C56H92O21/c1-26(57)34-19-42(59)56(62)54(34,8)41(58)25-40-53(7)16-15-33(18-32(53)14-17-55(40,56)61)73-43-21-36(64-10)49(28(3)69-43)75-45-23-38(66-12)51(30(5)71-45)77-47-24-39(67-13)52(31(6)72-47)76-46-22-37(65-11)50(29(4)70-46)74-44-20-35(63-9)48(60)27(2)68-44/h14,27-31,33-52,58-62H,15-25H2,1-13H3/t27-,28-,29+,30+,31-,33+,34+,35-,36-,37-,38+,39-,40-,41-,42-,43+,44+,45-,46-,47+,48-,49-,50+,51+,52-,53+,54+,55+,56-/m1/s1
InChIKey RBUKIWDTVRYITP-WCWWIOLWSA-N
Mol Weight 1101.3 g/mol
Molecular Formula C56H92O21
Exact Mass 1100.61311 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HuL5UJLEDZV
Name 15-BETA-HYDROXYLINEOLON-3-O-BETA-D-OLEANDROPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSYL-(1->4)-BETA-D-OLEANDROPYRANOSYL-(1->4)-BETA-D-OLEANDROPY
Compound Number 22
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C56H92O21
InChI InChI=1S/C56H92O21/c1-26(57)34-19-42(59)56(62)54(34,8)41(58)25-40-53(7)16-15-33(18-32(53)14-17-55(40,56)61)73-43-21-36(64-10)49(28(3)69-43)75-45-23-38(66-12)51(30(5)71-45)77-47-24-39(67-13)52(31(6)72-47)76-46-22-37(65-11)50(29(4)70-46)74-44-20-35(63-9)48(60)27(2)68-44/h14,27-31,33-52,58-62H,15-25H2,1-13H3/t27-,28-,29+,30+,31-,33+,34+,35-,36-,37-,38+,39-,40-,41-,42-,43+,44+,45-,46-,47+,48-,49-,50+,51+,52-,53+,54+,55+,56-/m1/s1
InChIKey RBUKIWDTVRYITP-WCWWIOLWSA-N
Literature Reference Author T.WARASHINA,T.NORO
Literature Reference Citation CHEM.PHARM.BULL.,48,99(2000)
Literature Reference DOI 10.1248/cpb.48.99
Molecular Weight 1101.334 g/mol
Solvent C5D5N
Source File Reference UWLU4836