![3-O-BETA-D-APIOFURANOSYL-(1->3)-BETA-D-GALACTOPYRANOSYL-(1->3)-[BETA-D-GLUCOPYRANOSYL-(1->2)]-ALPHA-L-ARABINOPYRANOSYL-OLEANOLIC-ACID](/api/spectrum/6MZc4j3bN8p/structure.png?h=300&w=458 "3-O-BETA-D-APIOFURANOSYL-(1->3)-BETA-D-GALACTOPYRANOSYL-(1->3)-[BETA-D-GLUCOPYRANOSYL-(1->2)]-ALPHA-L-ARABINOPYRANOSYL-OLEANOLIC-ACID")
| SpectraBase Compound ID | 9V9Gh4kXtWo |
|---|---|
| InChI | InChI=1S/C52H84O21/c1-46(2)14-16-51(45(63)64)17-15-49(6)24(25(51)18-46)8-9-30-48(5)12-11-31(47(3,4)29(48)10-13-50(30,49)7)70-43-39(73-41-35(60)34(59)32(57)27(19-53)68-41)37(26(56)21-66-43)71-42-36(61)38(33(58)28(20-54)69-42)72-44-40(62)52(65,22-55)23-67-44/h8,25-44,53-62,65H,9-23H2,1-7H3,(H,63,64)/t25-,26+,27+,28-,29-,30+,31-,32+,33+,34-,35+,36-,37+,38+,39?,40+,41-,42+,43+,44+,48-,49+,50+,51-,52-/m0/s1 |
| InChIKey | RNHJWTZWGPZQOH-SFHRTSRESA-N |
| Mol Weight | 1045.2 g/mol |
| Molecular Formula | C52H84O21 |
| Exact Mass | 1044.55051 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6MZc4j3bN8p |
|---|---|
| Name | 3-O-BETA-D-APIOFURANOSYL-(1->3)-BETA-D-GALACTOPYRANOSYL-(1->3)-[BETA-D-GLUCOPYRANOSYL-(1->2)]-ALPHA-L-ARABINOPYRANOSYL-OLEANOLIC-ACID |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C52H84O21 |
| InChI | InChI=1S/C52H84O21/c1-46(2)14-16-51(45(63)64)17-15-49(6)24(25(51)18-46)8-9-30-48(5)12-11-31(47(3,4)29(48)10-13-50(30,49)7)70-43-39(73-41-35(60)34(59)32(57)27(19-53)68-41)37(26(56)21-66-43)71-42-36(61)38(33(58)28(20-54)69-42)72-44-40(62)52(65,22-55)23-67-44/h8,25-44,53-62,65H,9-23H2,1-7H3,(H,63,64)/t25-,26+,27+,28-,29-,30+,31-,32+,33+,34-,35+,36-,37+,38+,39?,40+,41-,42+,43+,44+,48-,49+,50+,51-,52-/m0/s1 |
| InChIKey | RNHJWTZWGPZQOH-SFHRTSRESA-N |
| Literature Reference Author | L.VOUTQUENNE,P.GUINOT,O.THOISON,T.SEVENET,C.LAVAUD |
| Literature Reference Citation | PHYTOCHEM.,64,781(2003) |
| Literature Reference DOI | 10.1016/S0031-9422(03)00380-7 |
| Molecular Weight | 1045.226 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWKP5849 |