| SpectraBase Compound ID | ItZIH9bK8Ia |
|---|---|
| InChI | InChI=1S/C36H58O8/c1-20(2)9-8-10-21(31(42)44-32-30(41)29(40)28(39)25(19-37)43-32)22-13-17-36(7)24-11-12-26-33(3,4)27(38)15-16-34(26,5)23(24)14-18-35(22,36)6/h9,21-22,25-30,32,37-41H,8,10-19H2,1-7H3/t21-,22+,25+,26-,27-,28+,29-,30+,32-,34+,35+,36-/m0/s1 |
| InChIKey | PWWSRMQRHVOIKE-JZKDWSMBSA-N |
| Mol Weight | 618.9 g/mol |
| Molecular Formula | C36H58O8 |
| Exact Mass | 618.413169 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KjsjQDajhyL |
|---|---|
| Name | FOMITOSIDE-I;TRAMENTENOLIC-ACID-21-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H58O8 |
| InChI | InChI=1S/C36H58O8/c1-20(2)9-8-10-21(31(42)44-32-30(41)29(40)28(39)25(19-37)43-32)22-13-17-36(7)24-11-12-26-33(3,4)27(38)15-16-34(26,5)23(24)14-18-35(22,36)6/h9,21-22,25-30,32,37-41H,8,10-19H2,1-7H3/t21-,22+,25+,26-,27-,28+,29-,30+,32-,34+,35+,36-/m0/s1 |
| InChIKey | PWWSRMQRHVOIKE-JZKDWSMBSA-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 | 618.852 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ8438 |