| SpectraBase Compound ID | bIO12wz4vZ |
|---|---|
| InChI | InChI=1S/C40H62O8/c1-12-22(3)33(45)47-31-32(48-34(46)23(4)13-2)40(21-41)25(20-35(31,5)6)24-14-15-27-37(9)18-17-28(42)36(7,8)26(37)16-19-38(27,10)39(24,11)29(43)30(40)44/h12-14,25-32,41-44H,15-21H2,1-11H3/b22-12-,23-13-/t25-,26?,27?,28?,29-,30-,31?,32-,37?,38?,39-,40-/m1/s1 |
| InChIKey | FWXLVXABZRYLST-OHAFABSGSA-N |
| Mol Weight | 670.9 g/mol |
| Molecular Formula | C40H62O8 |
| Exact Mass | 670.444469 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EhlYnsJQE8H |
|---|---|
| Name | Hippocaesculin |
| Comments | broad-band decoupling (BB) |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C40H62O8 |
| InChI | InChI=1S/C40H62O8/c1-12-22(3)33(45)47-31-32(48-34(46)23(4)13-2)40(21-41)25(20-35(31,5)6)24-14-15-27-37(9)18-17-28(42)36(7,8)26(37)16-19-38(27,10)39(24,11)29(43)30(40)44/h12-14,25-32,41-44H,15-21H2,1-11H3/b22-12-,23-13-/t25-,26?,27?,28?,29-,30-,31?,32-,37?,38?,39-,40-/m1/s1 |
| InChIKey | FWXLVXABZRYLST-OHAFABSGSA-N |
| Instrument Name | SF = 250 MHz |
| Literature Reference | J. Nat. Products 49, 650 (1986). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | Pyridine-D5 |