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1-(O-ALPHA-D-MANNOPYRANOSYL)-(3R,25S,27R)-OCTACOSANETRIOL
SpectraBase Compound ID LLTpmHTqll0
InChI InChI=1S/C34H68O9/c1-27(36)25-29(38)22-20-18-16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-17-19-21-28(37)23-24-42-34-33(41)32(40)31(39)30(26-35)43-34/h27-41H,2-26H2,1H3/t27-,28-,29+,30+,31+,32-,33-,34-/m0/s1
InChIKey YTSUVFCOVQACBU-CZUUUSEHSA-N
Mol Weight 620.9 g/mol
Molecular Formula C34H68O9
Exact Mass 620.486334 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CDeO7qmVGF1
Name 1-(O-ALPHA-D-MANNOPYRANOSYL)-(3R,25S,27R)-OCTACOSANETRIOL
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H68O9
InChI InChI=1S/C34H68O9/c1-27(36)25-29(38)22-20-18-16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-17-19-21-28(37)23-24-42-34-33(41)32(40)31(39)30(26-35)43-34/h27-41H,2-26H2,1H3/t27-,28-,29+,30+,31+,32-,33-,34-/m0/s1
InChIKey YTSUVFCOVQACBU-CZUUUSEHSA-N
Literature Reference Author A.GAMBACORTA,E.PAGNOTTA,I.ROMANA,G.SODANO,A.TRINCONE
Literature Reference Citation PHYTOCHEM.,48,801(1998)
Literature Reference DOI 10.1016/S0031-9422(97)00954-0
Molecular Weight 620.909 g/mol
Solvent C5D5N
Source File Reference UWMS1197