| SpectraBase Compound ID | G2ALSVDcv74 |
|---|---|
| InChI | InChI=1S/C48H71NO16/c1-25-40(51)32(56-7)20-38(59-25)64-42-27(3)61-39(22-34(42)58-9)65-41-26(2)60-37(21-33(41)57-8)62-31-13-14-44(5)30(19-31)12-15-47(54)35(44)23-36(63-43(52)29-11-10-18-49-24-29)45(6)46(53,28(4)50)16-17-48(45,47)55/h10-12,18,24-27,31-42,51,53-55H,13-17,19-23H2,1-9H3/t25-,26-,27+,31+,32-,33+,34-,35-,36-,37+,38+,39-,40-,41-,42+,44+,45-,46-,47+,48-/m1/s1 |
| InChIKey | KGBKRGOQFYYJML-PNMXQVIUSA-N |
| Mol Weight | 918.1 g/mol |
| Molecular Formula | C48H71NO16 |
| Exact Mass | 917.477285 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E21s7v5BlQI |
|---|---|
| Name | ROSTRATAMINE-3-O-BETA-D-OLEANDROPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H71NO16 |
| InChI | InChI=1S/C48H71NO16/c1-25-40(51)32(56-7)20-38(59-25)64-42-27(3)61-39(22-34(42)58-9)65-41-26(2)60-37(21-33(41)57-8)62-31-13-14-44(5)30(19-31)12-15-47(54)35(44)23-36(63-43(52)29-11-10-18-49-24-29)45(6)46(53,28(4)50)16-17-48(45,47)55/h10-12,18,24-27,31-42,51,53-55H,13-17,19-23H2,1-9H3/t25-,26-,27+,31+,32-,33+,34-,35-,36-,37+,38+,39-,40-,41-,42+,44+,45-,46-,47+,48-/m1/s1 |
| InChIKey | KGBKRGOQFYYJML-PNMXQVIUSA-N |
| Literature Reference Author | T.WARASHINA,T.NORO |
| Literature Reference Citation | CHEM.PHARM.BULL.,44,358(1996) |
| Literature Reference DOI | 10.1248/cpb.44.358 |
| Molecular Weight | 918.089 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU31457 |