SpectraBase Compound ID | 2CS0zI0Iphf |
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InChI | InChI=1S/C42H68O13/c1-37(2)14-16-42(36(50)51)17-15-40(6)21(22(42)18-37)8-9-26-39(5)12-11-27(38(3,4)25(39)10-13-41(26,40)7)54-35-33(31(48)29(46)24(20-44)53-35)55-34-32(49)30(47)28(45)23(19-43)52-34/h8,22-35,43-49H,9-20H2,1-7H3,(H,50,51)/t22-,23+,24+,25-,26+,27-,28+,29+,30-,31-,32+,33+,34-,35-,39-,40+,41+,42-/m0/s1 |
InChIKey | LEQCLUFJRGKLOA-WLMDKFIXSA-N |
Mol Weight | 781.0 g/mol |
Molecular Formula | C42H68O13 |
Exact Mass | 780.465992 g/mol |
SpectraBase Spectrum ID | AlNsL7ddi1i |
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Name | 3-O-BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL-OLEANOLIC-ACID |
Compound Number | 4 |
Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C42H68O13 |
InChI | InChI=1S/C42H68O13/c1-37(2)14-16-42(36(50)51)17-15-40(6)21(22(42)18-37)8-9-26-39(5)12-11-27(38(3,4)25(39)10-13-41(26,40)7)54-35-33(31(48)29(46)24(20-44)53-35)55-34-32(49)30(47)28(45)23(19-43)52-34/h8,22-35,43-49H,9-20H2,1-7H3,(H,50,51)/t22-,23+,24+,25-,26+,27-,28+,29+,30-,31-,32+,33+,34-,35-,39-,40+,41+,42-/m0/s1 |
InChIKey | LEQCLUFJRGKLOA-WLMDKFIXSA-N |
Literature Reference Author | F.H.REGINATTO,C.KAUFFMANN,J.SCHRIPSEMA,D.GUILLAUME,G.GOSMANN ,E.P.SCHENKEL |
Literature Reference Citation | J.BRAZ.CHEM.SOC.,12,32(2001) |
Molecular Weight | 780.994 g/mol |
Solvent | C5D5N |
Source File Reference | UWPA1262 |