| SpectraBase Compound ID | CCFqoX18gMW |
|---|---|
| InChI | InChI=1S/C58H94O26/c1-53(2)14-16-58(52(74)84-50-44(73)40(69)37(66)30(80-50)23-77-47-42(71)38(67)35(64)28(19-59)78-47)17-15-56(6)24(25(58)18-53)8-9-32-55(5)12-11-33(54(3,4)31(55)10-13-57(32,56)7)81-51-46(83-48-41(70)34(63)26(61)21-75-48)45(27(62)22-76-51)82-49-43(72)39(68)36(65)29(20-60)79-49/h8,25-51,59-73H,9-23H2,1-7H3/t25?,26-,27+,28-,29-,30-,31?,32?,33+,34+,35-,36-,37-,38+,39+,40+,41-,42-,43-,44-,45+,46-,47-,48+,49+,50+,51+,55+,56-,57-,58+/m1/s1 |
| InChIKey | RFXXERXFXNFWNS-BWWKXRMSSA-N |
| Mol Weight | 1207.4 g/mol |
| Molecular Formula | C58H94O26 |
| Exact Mass | 1206.603333 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6g6g4DHRV04 |
|---|---|
| Name | ARALIASAPONIN-III;28-O-BETA-D-GLUCOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSYL-OLEANOLIC-ACID-3-O-BETA-D-GLUCOPYRANOSYL-(1->3)-[BETA-D-XYLOPYRANO |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C58H94O26 |
| InChI | InChI=1S/C58H94O26/c1-53(2)14-16-58(52(74)84-50-44(73)40(69)37(66)30(80-50)23-77-47-42(71)38(67)35(64)28(19-59)78-47)17-15-56(6)24(25(58)18-53)8-9-32-55(5)12-11-33(54(3,4)31(55)10-13-57(32,56)7)81-51-46(83-48-41(70)34(63)26(61)21-75-48)45(27(62)22-76-51)82-49-43(72)39(68)36(65)29(20-60)79-49/h8,25-51,59-73H,9-23H2,1-7H3/t25?,26-,27+,28-,29-,30-,31?,32?,33+,34+,35-,36-,37-,38+,39+,40+,41-,42-,43-,44-,45+,46-,47-,48+,49+,50+,51+,55+,56-,57-,58+/m1/s1 |
| InChIKey | RFXXERXFXNFWNS-BWWKXRMSSA-N |
| Literature Reference Author | T.MIYASE,K.I.SHIOKAWA,D.M.ZHANG,A.UENO |
| Literature Reference Citation | PHYTOCHEM.,41,1411(1996) |
| Literature Reference DOI | 10.1016/0031-9422(95)00788-1 |
| Molecular Weight | 1207.369 g/mol |
| Solvent | Unknown |
| Source File Reference | UWLU4426 |