| SpectraBase Compound ID | KHCtI1m9YZh |
|---|---|
| InChI | InChI=1S/C44H60O8/c1-39(2)32-16-19-44(7)33(42(32,5)18-17-34(39)52-38(50)29-13-9-11-27(29)36(47)48)15-14-30-31-24-40(3,20-21-41(31,4)22-23-43(30,44)6)25-51-37(49)28-12-8-10-26(28)35(45)46/h14-15,32-34H,8-13,16-25H2,1-7H3,(H,45,46)(H,47,48)/t32-,33+,34-,40-,41?,42?,43?,44?/m0/s1 |
| InChIKey | NULZIVDMKNIYHK-UBEMVILOSA-N |
| Mol Weight | 717.0 g/mol |
| Molecular Formula | C44H60O8 |
| Exact Mass | 716.428819 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BCbSXRJ3Gyd |
|---|---|
| Name | 3-BETA,30-O-BIS-(2-CARBOXYL-1-CYCLOPENTENECARBONYL)-OLEAN-11,13(18)-DIEN |
| Compound Number | 12 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H60O8 |
| InChI | InChI=1S/C44H60O8/c1-39(2)32-16-19-44(7)33(42(32,5)18-17-34(39)52-38(50)29-13-9-11-27(29)36(47)48)15-14-30-31-24-40(3,20-21-41(31,4)22-23-43(30,44)6)25-51-37(49)28-12-8-10-26(28)35(45)46/h14-15,32-34H,8-13,16-25H2,1-7H3,(H,45,46)(H,47,48)/t32-,33+,34-,40-,41?,42?,43?,44?/m0/s1 |
| InChIKey | NULZIVDMKNIYHK-UBEMVILOSA-N |
| Literature Reference Author | M.TSUKAHARA,T.NISHINO,I.FURUHASHI,H.INOUE,T.SATO,H.MATSUMOTO |
| Literature Reference Citation | CHEM.PHARM.BULL.,53,1103(2005) |
| Literature Reference DOI | 10.1248/cpb.53.1103 |
| Molecular Weight | 716.956 g/mol |
| Sample ID | 54166 |
| Solvent | C5D5N |