| SpectraBase Compound ID | F5JlfzqRUWW |
|---|---|
| InChI | InChI=1S/C37H58O8/c1-21(2)10-9-11-23(32(42)45-33-31(41)30(40)27(39)20-43-33)24-14-18-37(8)26-12-13-28-34(4,5)29(44-22(3)38)16-17-35(28,6)25(26)15-19-36(24,37)7/h10,23-24,27-31,33,39-41H,9,11-20H2,1-8H3/t23-,24+,27+,28-,29+,30-,31+,33-,35+,36+,37-/m0/s1 |
| InChIKey | NLXRBHRYKXMKNJ-KDLUYPNPSA-N |
| Mol Weight | 630.9 g/mol |
| Molecular Formula | C37H58O8 |
| Exact Mass | 630.413169 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9OlQuk6GL6m |
|---|---|
| Name | FOMITOSIDE-F;3-ALPHA-ACETOXYLANOST-8,24-DIEN-21-OIC-ACID-21-O-BETA-D-XYLOPYRANOSIDE |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H58O8 |
| InChI | InChI=1S/C37H58O8/c1-21(2)10-9-11-23(32(42)45-33-31(41)30(40)27(39)20-43-33)24-14-18-37(8)26-12-13-28-34(4,5)29(44-22(3)38)16-17-35(28,6)25(26)15-19-36(24,37)7/h10,23-24,27-31,33,39-41H,9,11-20H2,1-8H3/t23-,24+,27+,28-,29+,30-,31+,33-,35+,36+,37-/m0/s1 |
| InChIKey | NLXRBHRYKXMKNJ-KDLUYPNPSA-N |
| Literature Reference Author | K.YOSHIKAWA,M.INOUE,Y.MATSUMOTO,C.SAKAKIBARA,H.MIYATAKA,H.MA TSUMOTO,S.ARIHARA |
| Literature Reference Citation | J.NAT.PROD.,68,69(2005) |
| Literature Reference DOI | 10.1021/np040130b |
| Molecular Weight | 630.863 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ8435 |