| SpectraBase Compound ID | 2oW9vGn94Zt |
|---|---|
| InChI | InChI=1S/C41H70O4/c1-10-11-12-13-14-15-16-17-18-35(44)45-34-22-24-39(7)30-20-19-29-36-28(27(2)3)21-23-38(36,6)26-33(43)40(29,8)41(30,9)32(42)25-31(39)37(34,4)5/h28-34,36,42-43H,2,10-26H2,1,3-9H3/t28-,29+,30+,31-,32-,33-,34-,36+,38+,39+,40-,41-/m0/s1 |
| InChIKey | FREKIZYSWNXLRV-JKQNRGPYSA-N |
| Mol Weight | 627.0 g/mol |
| Molecular Formula | C41H70O4 |
| Exact Mass | 626.527411 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CPZBwmDjF7e |
|---|---|
| Name | LUP-20(29)-ENE-3-BETA,7-BETA,15-ALPHA-TRIOL;ESTER_WITH_UNDECANOIC-ACID |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H70O4 |
| InChI | InChI=1S/C41H70O4/c1-10-11-12-13-14-15-16-17-18-35(44)45-34-22-24-39(7)30-20-19-29-36-28(27(2)3)21-23-38(36,6)26-33(43)40(29,8)41(30,9)32(42)25-31(39)37(34,4)5/h28-34,36,42-43H,2,10-26H2,1,3-9H3/t28-,29+,30+,31-,32-,33-,34-,36+,38+,39+,40-,41-/m0/s1 |
| InChIKey | FREKIZYSWNXLRV-JKQNRGPYSA-N |
| Literature Reference Author | T.FUKUNAGA,K.NISHIYA,I.KAJIKAWA,Y.WATANABE,N.SUZUKI,K.TAKEYA ,H.ITOKAWA |
| Literature Reference Citation | CHEM.PHARM.BULL.,36,1180(1988) |
| Literature Reference DOI | 10.1248/cpb.36.1180 |
| Molecular Weight | 627.004 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWBK69 |