| SpectraBase Compound ID | Co64c7hRwgw |
|---|---|
| InChI | InChI=1S/C33H48O10/c1-15-17(14-41-32-30(39)29(38)28(37)27(13-34)43-32)10-26(42-31(15)40)16(2)23-6-7-24-21-12-25(36)22-11-18(35)4-5-19(22)20(21)8-9-33(23,24)3/h16,18,20-21,23-24,26-30,32,34-35,37-39H,4-14H2,1-3H3/t16-,18+,20+,21+,23+,24-,26+,27+,28+,29-,30+,32+,33+/m0/s1 |
| InChIKey | GCUKFNAJZUUBSQ-HCGFFNIQSA-N |
| Mol Weight | 604.7 g/mol |
| Molecular Formula | C33H48O10 |
| Exact Mass | 604.324748 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ATiaYGzg7ME |
|---|---|
| Name | WITHALONGOLIDE_N;28-O-BETA-D-GLUCOPYRANOSYL-3-ALPHA-HYDROXY-6-OXO-19-NORWITHA-5-(10),24-DIENOLIDE |
| Compound Number | 14 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H48O10 |
| InChI | InChI=1S/C33H48O10/c1-15-17(14-41-32-30(39)29(38)28(37)27(13-34)43-32)10-26(42-31(15)40)16(2)23-6-7-24-21-12-25(36)22-11-18(35)4-5-19(22)20(21)8-9-33(23,24)3/h16,18,20-21,23-24,26-30,32,34-35,37-39H,4-14H2,1-3H3/t16-,18+,20+,21+,23+,24-,26+,27+,28+,29-,30+,32+,33+/m0/s1 |
| InChIKey | GCUKFNAJZUUBSQ-HCGFFNIQSA-N |
| Literature Reference Author | H.ZHANG,A.K.SAMADI,R.J.GALLAGHER,J.J.ARAYA,X.TONG,V.W.DAY,M. S.COHEN,K.KINDSCHER, |
| Literature Reference Citation | J.NAT.PROD.,74,2532(2011) |
| Literature Reference DOI | 10.1021/np200635r |
| Molecular Weight | 604.738 g/mol |
| Sample ID | 39642 |
| Solvent | C5D5N |