| SpectraBase Compound ID | 3WDCFjlnfSB |
|---|---|
| InChI | InChI=1S/C25H32O6/c1-7-11(2)20(26)29-19-13(4)10-24-22-23(6,30-22)18-16-14(5)21(27)28-15(16)9-8-12(3)17(18)25(19,24)31-24/h11,13,15,17-19,22H,3,7-10H2,1-2,4-6H3/t11-,13+,15-,17+,18+,19+,22-,23-,24-,25-/m0/s1 |
| InChIKey | ZKVAYCBMGTZJNA-OZEWEVPBSA-N |
| Mol Weight | 428.5 g/mol |
| Molecular Formula | C25H32O6 |
| Exact Mass | 428.219889 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8at1Yl8O4zU |
|---|---|
| Name | CROTOCASCARIN-D |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H32O6 |
| InChI | InChI=1S/C25H32O6/c1-7-11(2)20(26)29-19-13(4)10-24-22-23(6,30-22)18-16-14(5)21(27)28-15(16)9-8-12(3)17(18)25(19,24)31-24/h11,13,15,17-19,22H,3,7-10H2,1-2,4-6H3/t11-,13+,15-,17+,18+,19+,22-,23-,24-,25-/m0/s1 |
| InChIKey | ZKVAYCBMGTZJNA-OZEWEVPBSA-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 | 428.525 g/mol |
| Source File Reference | UWBT4889 |