| SpectraBase Compound ID | 6gqOyqW0SZS |
|---|---|
| InChI | InChI=1S/C37H60O8/c1-20(2)21(3)9-10-22(32(43)45-33-31(42)30(41)29(40)26(19-38)44-33)23-13-17-37(8)25-11-12-27-34(4,5)28(39)15-16-35(27,6)24(25)14-18-36(23,37)7/h20,22-23,26-31,33,38-42H,3,9-19H2,1-2,4-8H3/t22-,23+,26+,27-,28-,29+,30-,31+,33-,35+,36+,37-/m0/s1 |
| InChIKey | PUTIRHSSEJKJRE-WADCKBOKSA-N |
| Mol Weight | 632.9 g/mol |
| Molecular Formula | C37H60O8 |
| Exact Mass | 632.428819 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1K7m0ltAqxa |
|---|---|
| Name | FOMITOSIDE-J;EBURICOIC-ACID-21-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 12 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H60O8 |
| InChI | InChI=1S/C37H60O8/c1-20(2)21(3)9-10-22(32(43)45-33-31(42)30(41)29(40)26(19-38)44-33)23-13-17-37(8)25-11-12-27-34(4,5)28(39)15-16-35(27,6)24(25)14-18-36(23,37)7/h20,22-23,26-31,33,38-42H,3,9-19H2,1-2,4-8H3/t22-,23+,26+,27-,28-,29+,30-,31+,33-,35+,36+,37-/m0/s1 |
| InChIKey | PUTIRHSSEJKJRE-WADCKBOKSA-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 | 632.879 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ8439 |