| SpectraBase Compound ID | 7jw4jLuohUA |
|---|---|
| InChI | InChI=1S/C41H66O16/c1-19-8-11-40(35(52)57-34-30(28(49)27(48)23(15-42)55-34)56-33-29(50)26(47)22(46)16-54-33)13-12-37(3)20(31(40)39(19,5)53)6-7-24-36(2)14-21(45)32(51)41(17-43,18-44)25(36)9-10-38(24,37)4/h6,19,21-34,42-51,53H,7-18H2,1-5H3/t19-,21+,22?,23?,24-,25+,26?,27?,28?,29?,30?,31+,32-,33?,34?,36+,37+,38-,39+,40-/m1/s1 |
| InChIKey | LXCSRXLMRXHCIO-KBGHKTQPSA-N |
| Mol Weight | 815.0 g/mol |
| Molecular Formula | C41H66O16 |
| Exact Mass | 814.435086 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Fu2rSjyqB9h |
|---|---|
| Name | Trachelosperoside-B-2 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C41H66O16 |
| InChI | InChI=1S/C41H66O16/c1-19-8-11-40(35(52)57-34-30(28(49)27(48)23(15-42)55-34)56-33-29(50)26(47)22(46)16-54-33)13-12-37(3)20(31(40)39(19,5)53)6-7-24-36(2)14-21(45)32(51)41(17-43,18-44)25(36)9-10-38(24,37)4/h6,19,21-34,42-51,53H,7-18H2,1-5H3/t19-,21+,22?,23?,24-,25+,26?,27?,28?,29?,30?,31+,32-,33?,34?,36+,37+,38-,39+,40-/m1/s1 |
| InChIKey | LXCSRXLMRXHCIO-KBGHKTQPSA-N |
| Instrument Name | SF = 400 MHz |
| Literature Reference | Chem. Pharm. Bull. 35, 1748 (1987). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | Pyridine-D5 |