| SpectraBase Compound ID | JQcvBNhRalb |
|---|---|
| InChI | InChI=1S/C35H56O8/c1-19(2)9-8-10-20(3)27-21-11-12-24-32(4)15-14-26(37)35(7,31(40)41)25(32)13-16-33(24,5)34(21,6)17-22(27)42-30-29(39)28(38)23(18-36)43-30/h9,21-30,36-39H,3,8,10-18H2,1-2,4-7H3,(H,40,41)/t21?,22-,23+,24?,25?,26+,27-,28+,29-,30-,32-,33-,34-,35+/m1/s1 |
| InChIKey | QDBTUBYMUFXZIA-XDYQEQIJSA-N |
| Mol Weight | 604.8 g/mol |
| Molecular Formula | C35H56O8 |
| Exact Mass | 604.397519 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JcYOaUUyxpi |
|---|---|
| Name | ROTUNDIFOLIC-ACID;(16R)-16-O-ALPHA-L-ARABINOFURANOSYL-3-BETA-HYDROXYDAMMARA-20,24-DIEN-29-OIC-ACID |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H56O8 |
| InChI | InChI=1S/C35H56O8/c1-19(2)9-8-10-20(3)27-21-11-12-24-32(4)15-14-26(37)35(7,31(40)41)25(32)13-16-33(24,5)34(21,6)17-22(27)42-30-29(39)28(38)23(18-36)43-30/h9,21-30,36-39H,3,8,10-18H2,1-2,4-7H3,(H,40,41)/t21?,22-,23+,24?,25?,26+,27-,28+,29-,30-,32-,33-,34-,35+/m1/s1 |
| InChIKey | QDBTUBYMUFXZIA-XDYQEQIJSA-N |
| Literature Reference Author | C.B.ROGERS |
| Literature Reference Citation | PHYTOCHEM.,40,833(1995) |
| Literature Reference DOI | 10.1016/0031-9422(95)00345-8 |
| Molecular Weight | 604.825 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS2517 |