| SpectraBase Compound ID | Dl9uzC6yegq |
|---|---|
| InChI | InChI=1S/C47H76O18/c1-21-9-14-47(42(59)65-41-36(57)34(55)32(53)26(18-49)62-41)16-15-45(5)23(30(47)22(21)2)7-8-28-43(3)12-11-29(44(4,20-50)27(43)10-13-46(28,45)6)63-39-37(58)38(24(51)19-60-39)64-40-35(56)33(54)31(52)25(17-48)61-40/h7,21-22,24-41,48-58H,8-20H2,1-6H3/t21-,22+,24+,25-,26-,27-,28-,29+,30+,31-,32-,33+,34+,35-,36-,37-,38+,39+,40+,41+,43+,44+,45-,46-,47+/m1/s1 |
| InChIKey | DLXQOPJKFDKIKX-RVDIZQJFSA-N |
| Mol Weight | 929.1 g/mol |
| Molecular Formula | C47H76O18 |
| Exact Mass | 928.503166 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GG1x0Q9rePH |
|---|---|
| Name | MATEGLYCOSIDE-B;3-O-BETA-D-GLUCOPYRANOSYL-(1->3)-ALPHA-L-ARABINOPYRANOSYL-23-HYDROXYUROLIC-ACID-28-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H76O18 |
| InChI | InChI=1S/C47H76O18/c1-21-9-14-47(42(59)65-41-36(57)34(55)32(53)26(18-49)62-41)16-15-45(5)23(30(47)22(21)2)7-8-28-43(3)12-11-29(44(4,20-50)27(43)10-13-46(28,45)6)63-39-37(58)38(24(51)19-60-39)64-40-35(56)33(54)31(52)25(17-48)61-40/h7,21-22,24-41,48-58H,8-20H2,1-6H3/t21-,22+,24+,25-,26-,27-,28-,29+,30+,31-,32-,33+,34+,35-,36-,37-,38+,39+,40+,41+,43+,44+,45-,46-,47+/m1/s1 |
| InChIKey | DLXQOPJKFDKIKX-RVDIZQJFSA-N |
| Literature Reference Author | S.SUGIMOTO,S.NAKAMURA,S.YAMAMOTO,C.YAMASHITA,Y.ODA,H.MATSUDA ,M.YOSHIKAWA |
| Literature Reference Citation | CHEM.PHARM.BULL.,57,257(2009) |
| Literature Reference DOI | 10.1248/cpb.57.257 |
| Molecular Weight | 929.110 g/mol |
| Sample ID | 2026 |
| Solvent | C5D5N |