#4;QM-4;METHYL-[4-O-(2R,3R)-NILOYL]-BETA-D-QUINOVOPYRANOSYL-(1->2)-O-BETA-D-GLUCOPYRANOSYL-(1->3)-[O-[4-O-(2R,3R)-NILOYL]-BETA-D-QUINOVOPYRANOSYL-(1->4)]-O-ALP

SpectraBase Compound ID	2WG0HYd0BHW
InChI	InChI=1S/C47H80O31/c1-12(14(3)50)40(63)72-33-17(6)67-42(30(60)28(33)58)74-35-19(8)69-44(77-39-27(57)24(54)21(11-49)71-47(39)78-37-25(55)22(52)16(5)66-45(37)65-9)32(62)36(35)75-46-38(26(56)23(53)20(10-48)70-46)76-43-31(61)29(59)34(18(7)68-43)73-41(64)13(2)15(4)51/h12-39,42-62H,10-11H2,1-9H3/t12-,13-,14-,15-,16-,17+,18-,19-,20-,21+,22+,23-,24+,25+,26+,27-,28+,29-,30+,31-,32+,33+,34-,35-,36-,37-,38-,39+,42-,43+,44-,45+,46+,47-/m1/s1
InChIKey	RLGYMZCETJHVTQ-RZBDVXRASA-N Google Search
Mol Weight	1141.1 g/mol
Molecular Formula	C47H80O31
Exact Mass	1140.468356 g/mol

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SpectraBase Spectrum ID	5cMDYkbXse8
Name	#4;QM-4;METHYL-[4-O-(2R,3R)-NILOYL]-BETA-D-QUINOVOPYRANOSYL-(1->2)-O-BETA-D-GLUCOPYRANOSYL-(1->3)-[O-[4-O-(2R,3R)-NILOYL]-BETA-D-QUINOVOPYRANOSYL-(1->4)]-O-ALP
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C47H80O31
InChI	InChI=1S/C47H80O31/c1-12(14(3)50)40(63)72-33-17(6)67-42(30(60)28(33)58)74-35-19(8)69-44(77-39-27(57)24(54)21(11-49)71-47(39)78-37-25(55)22(52)16(5)66-45(37)65-9)32(62)36(35)75-46-38(26(56)23(53)20(10-48)70-46)76-43-31(61)29(59)34(18(7)68-43)73-41(64)13(2)15(4)51/h12-39,42-62H,10-11H2,1-9H3/t12-,13-,14-,15-,16-,17+,18-,19-,20-,21+,22+,23-,24+,25+,26+,27-,28+,29-,30+,31-,32+,33+,34-,35-,36-,37-,38-,39+,42-,43+,44-,45+,46+,47-/m1/s1
InChIKey	RLGYMZCETJHVTQ-RZBDVXRASA-N
Literature Reference Author	K.AKIYAMA,T.MINENO,M.OKAWA,J.KINJO,H.MIYASHITA,H.YOSHIMITSU, T.NOHARA,M.ONO
Literature Reference Citation	CHEM.PHARM.BULL.,61,952(2013)
Literature Reference DOI	10.1248/cpb.c13-00355
Molecular Weight	1141.134 g/mol
Source File Reference	UWIR4133