| SpectraBase Compound ID | eYJ5GhpHGW |
|---|---|
| InChI | InChI=1S/C47H76O17/c1-22-30(51)36(63-38-34(55)33(54)32(53)26(19-48)61-38)35(56)39(60-22)64-37-31(52)25(50)20-59-40(37)62-29-11-12-43(4)27(44(29,5)21-49)10-13-46(7)28(43)9-8-23-24-18-42(2,3)14-16-47(24,41(57)58)17-15-45(23,46)6/h8,22,24-40,48-56H,9-21H2,1-7H3,(H,57,58)/t22-,24?,25-,26+,27?,28?,29-,30-,31-,32+,33-,34+,35+,36+,37+,38-,39+,40+,43-,44-,45+,46+,47-/m0/s1 |
| InChIKey | AMXYFWUYMQOLRN-WQTHYRRCSA-N |
| Mol Weight | 913.1 g/mol |
| Molecular Formula | C47H76O17 |
| Exact Mass | 912.508251 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 47UgYCGf2lh |
|---|---|
| Name | HEDERAGENIN-3-O-BETA-D-GLUCOPYRANOSYL-(1->3)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H76O17 |
| InChI | InChI=1S/C47H76O17/c1-22-30(51)36(63-38-34(55)33(54)32(53)26(19-48)61-38)35(56)39(60-22)64-37-31(52)25(50)20-59-40(37)62-29-11-12-43(4)27(44(29,5)21-49)10-13-46(7)28(43)9-8-23-24-18-42(2,3)14-16-47(24,41(57)58)17-15-45(23,46)6/h8,22,24-40,48-56H,9-21H2,1-7H3,(H,57,58)/t22-,24?,25-,26+,27?,28?,29-,30-,31-,32+,33-,34+,35+,36+,37+,38-,39+,40+,43-,44-,45+,46+,47-/m0/s1 |
| InChIKey | AMXYFWUYMQOLRN-WQTHYRRCSA-N |
| Literature Reference Author | K.Y.JUNG,J.C.DO,K.H.SON |
| Literature Reference Citation | J.NAT.PROD.,56,1912(1993) |
| Literature Reference DOI | 10.1021/np50101a007 |
| Molecular Weight | 913.110 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWCS5171 |