| SpectraBase Compound ID | JJnijqtdC9G |
|---|---|
| InChI | InChI=1S/C25H32O8/c1-7-10(2)19(27)30-18-11(3)8-23-21-22(6,32-21)17-15-13(5)20(28)31-24(15,29)9-14(26)12(4)16(17)25(18,23)33-23/h10-11,14,16-18,21,26,29H,4,7-9H2,1-3,5-6H3/t10-,11+,14-,16+,17+,18+,21-,22-,23-,24-,25-/m0/s1 |
| InChIKey | MQJFAOGVTYDNID-VAEWFXHBSA-N |
| Mol Weight | 460.5 g/mol |
| Molecular Formula | C25H32O8 |
| Exact Mass | 460.209718 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9WjPmNYILq |
|---|---|
| Name | CROTOCASCARIN-C |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H32O8 |
| InChI | InChI=1S/C25H32O8/c1-7-10(2)19(27)30-18-11(3)8-23-21-22(6,32-21)17-15-13(5)20(28)31-24(15,29)9-14(26)12(4)16(17)25(18,23)33-23/h10-11,14,16-18,21,26,29H,4,7-9H2,1-3,5-6H3/t10-,11+,14-,16+,17+,18+,21-,22-,23-,24-,25-/m0/s1 |
| InChIKey | MQJFAOGVTYDNID-VAEWFXHBSA-N |
| Literature Reference Author | S.KAWAKAMI,H.TOYODA,L.HARINANTENAINA,K.MATSUNAMI,H.OTSUKA,T. SHINZATO,Y.TAKEDA |
| Literature Reference Citation | CHEM.PHARM.BULL.,61,411(2013) |
| Literature Reference DOI | 10.1248/cpb.c12-01002 |
| Molecular Weight | 460.524 g/mol |
| Source File Reference | UWBT4888 |