| SpectraBase Compound ID | 85VSeg1mqcW |
|---|---|
| InChI | InChI=1S/C36H56O10/c1-18-9-12-36(31(44)46-30-28(42)27(41)26(40)22(16-37)45-30)14-13-34(5)20(25(36)19(18)2)7-8-24-32(3)15-21(39)29(43)33(4,17-38)23(32)10-11-35(24,34)6/h7,18,21-24,26-30,37-43H,8-17H2,1-6H3/t18-,21-,22-,23-,24-,26-,27+,28-,29-,30+,32+,33+,34-,35-,36+/m1/s1 |
| InChIKey | YUQOBDWWVKXUMV-DUHBLQKFSA-N |
| Mol Weight | 648.8 g/mol |
| Molecular Formula | C36H56O10 |
| Exact Mass | 648.387348 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | FtiQnK1CiNr |
|---|---|
| Name | RUBUSIDE_C;2-ALPHA,3-ALPHA,23-TRIHYDROXY-URS-12,18-DIEN-28_OIC_ACID_28-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H56O10 |
| InChI | InChI=1S/C36H56O10/c1-18-9-12-36(31(44)46-30-28(42)27(41)26(40)22(16-37)45-30)14-13-34(5)20(25(36)19(18)2)7-8-24-32(3)15-21(39)29(43)33(4,17-38)23(32)10-11-35(24,34)6/h7,18,21-24,26-30,37-43H,8-17H2,1-6H3/t18-,21-,22-,23-,24-,26-,27+,28-,29-,30+,32+,33+,34-,35-,36+/m1/s1 |
| InChIKey | YUQOBDWWVKXUMV-DUHBLQKFSA-N |
| Literature Reference Author | W.LI,H.FU,H.BAI,T.SASAKI,H.KATO,K.KOIKE |
| Literature Reference Citation | J.NAT.PROD.,72,1755(2009) |
| Literature Reference DOI | 10.1021/np900237a |
| Molecular Weight | 648.835 g/mol |
| Sample ID | 33616 |
| Solvent | C5D5N |