| SpectraBase Compound ID | IE6MJs1bqah |
|---|---|
| InChI | InChI=1S/C45H68O15/c1-26-12-14-32-42(3,24-46)16-10-18-44(32,5)30(26)22-59-37(41(54)57-9)29(21-35(49)50)39(52)60-25-43(4)17-11-19-45(6)31(27(2)13-15-33(43)45)23-58-36(40(53)56-8)28(20-34(47)48)38(51)55-7/h28-33,36-37,46H,1-2,10-25H2,3-9H3,(H,47,48)(H,49,50)/t28-,29+,30+,31+,32?,33?,36-,37+,42+,43+,44+,45-/m0/s1 |
| InChIKey | PCFMECNNYYMDRS-DQSCEKNSSA-N |
| Mol Weight | 849.0 g/mol |
| Molecular Formula | C45H68O15 |
| Exact Mass | 848.455821 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BnTJRIhOtxt |
|---|---|
| Name | 15-HYDROXY-CRYPTOPORIC ACID C |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C45H68O15 |
| InChI | InChI=1S/C45H68O15/c1-26-12-14-32-42(3,24-46)16-10-18-44(32,5)30(26)22-59-37(41(54)57-9)29(21-35(49)50)39(52)60-25-43(4)17-11-19-45(6)31(27(2)13-15-33(43)45)23-58-36(40(53)56-8)28(20-34(47)48)38(51)55-7/h28-33,36-37,46H,1-2,10-25H2,3-9H3,(H,47,48)(H,49,50)/t28-,29+,30+,31+,32?,33?,36-,37+,42+,43+,44+,45-/m0/s1 |
| InChIKey | PCFMECNNYYMDRS-DQSCEKNSSA-N |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |