| SpectraBase Compound ID | LI0QRAVEyLd |
|---|---|
| InChI | InChI=1S/C45H72O16/c1-19-9-14-45(54-18-19)20(2)30-28(61-45)16-27-25-8-7-23-15-24(10-12-43(23,5)26(25)11-13-44(27,30)6)57-42-39(60-41-36(52)34(50)32(48)22(4)56-41)37(53)38(29(17-46)58-42)59-40-35(51)33(49)31(47)21(3)55-40/h7,19-22,24-42,46-53H,8-18H2,1-6H3/t19-,20+,21-,22-,24+,25?,26?,27?,28?,29+,30?,31-,32-,33+,34+,35+,36+,37-,38+,39+,40-,41-,42+,43+,44+,45?/m0/s1 |
| InChIKey | VNONINPVFQTJOC-NORCSRLZSA-N |
| Mol Weight | 869.1 g/mol |
| Molecular Formula | C45H72O16 |
| Exact Mass | 868.482036 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8yj02rVici2 |
|---|---|
| Name | DIOSCIN |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C45H72O16 |
| InChI | InChI=1S/C45H72O16/c1-19-9-14-45(54-18-19)20(2)30-28(61-45)16-27-25-8-7-23-15-24(10-12-43(23,5)26(25)11-13-44(27,30)6)57-42-39(60-41-36(52)34(50)32(48)22(4)56-41)37(53)38(29(17-46)58-42)59-40-35(51)33(49)31(47)21(3)55-40/h7,19-22,24-42,46-53H,8-18H2,1-6H3/t19-,20+,21-,22-,24+,25?,26?,27?,28?,29+,30?,31-,32-,33+,34+,35+,36+,37-,38+,39+,40-,41-,42+,43+,44+,45?/m0/s1 |
| InChIKey | VNONINPVFQTJOC-NORCSRLZSA-N |
| Instrument Name | Bruker HX-90 |
| Literature Reference | V.A.PASESHNICHENKO, A.R.GUSEVA, L.I.STRIGINA, V.V.ISAKOV (1981) Dokl.Akad.NaukSSSR(Russ. Lang.): v.256, N3, 742-745. |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | C5D5N pyridine-d5 |