![3-O-[2,3,4,6-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL-(1->3)-2,4,6-TRI-O-ACETYL-BETA-D-GLUCOPYRANOSYL]-OLEANOLIC_ACID](/api/spectrum/2wkFPAKAQ0F/structure.png?h=300&w=458 "3-O-[2,3,4,6-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL-(1->3)-2,4,6-TRI-O-ACETYL-BETA-D-GLUCOPYRANOSYL]-OLEANOLIC_ACID")
| SpectraBase Compound ID | BPsaIrg7jRk |
|---|---|
| InChI | InChI=1S/C56H82O20/c1-28(57)66-26-37-42(68-30(3)59)44(70-32(5)61)46(71-33(6)62)49(74-37)76-45-43(69-31(4)60)38(27-67-29(2)58)73-48(47(45)72-34(7)63)75-41-18-19-53(12)39(52(41,10)11)17-20-55(14)40(53)16-15-35-36-25-51(8,9)21-23-56(36,50(64)65)24-22-54(35,55)13/h15,36-49H,16-27H2,1-14H3,(H,64,65)/t36?,37-,38-,39?,40?,41?,42-,43-,44+,45+,46-,47-,48+,49+,53?,54?,55?,56?/m1/s1 |
| InChIKey | OPNUYVVRUIEBHX-ZCHAKCFNSA-N |
| Mol Weight | 1075.3 g/mol |
| Molecular Formula | C56H82O20 |
| Exact Mass | 1074.539945 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2wkFPAKAQ0F |
|---|---|
| Name | 3-O-[2,3,4,6-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL-(1->3)-2,4,6-TRI-O-ACETYL-BETA-D-GLUCOPYRANOSYL]-OLEANOLIC_ACID |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C56H82O20 |
| InChI | InChI=1S/C56H82O20/c1-28(57)66-26-37-42(68-30(3)59)44(70-32(5)61)46(71-33(6)62)49(74-37)76-45-43(69-31(4)60)38(27-67-29(2)58)73-48(47(45)72-34(7)63)75-41-18-19-53(12)39(52(41,10)11)17-20-55(14)40(53)16-15-35-36-25-51(8,9)21-23-56(36,50(64)65)24-22-54(35,55)13/h15,36-49H,16-27H2,1-14H3,(H,64,65)/t36?,37-,38-,39?,40?,41?,42-,43-,44+,45+,46-,47-,48+,49+,53?,54?,55?,56?/m1/s1 |
| InChIKey | OPNUYVVRUIEBHX-ZCHAKCFNSA-N |
| Literature Reference Author | E.LEMMICH,C.CORNETT,P.FURU,C.L.JORSTIAN,A.D.KNUDSEN,C.E.OLSE N,A.SALIH,S.T.THIILB |
| Literature Reference Citation | PHYTOCHEM.,39,63(1995) |
| Literature Reference DOI | 10.1016/0031-9422(94)00866-R |
| Molecular Weight | 1075.255 g/mol |
| Solvent | Unknown |
| Source File Reference | UWMZ8305 |