| SpectraBase Compound ID | K3tiiz2szwd |
|---|---|
| InChI | InChI=1S/C32H48O6/c1-19(2)22-12-13-24-23(30(22,6)16-15-26(34)38-9)14-17-31(7)27(25(33)18-32(24,31)8)21(28(35)36)11-10-20(3)29(4,5)37/h13-14,21-22,25,27,33,37H,1,3,10-12,15-18H2,2,4-9H3,(H,35,36)/t21?,22-,25+,27-,30-,31+,32+/m0/s1 |
| InChIKey | BLNBMYVNDVNBFI-GJCLTXCZSA-N |
| Mol Weight | 528.7 g/mol |
| Molecular Formula | C32H48O6 |
| Exact Mass | 528.345089 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6jk0GNrrrWY |
|---|---|
| Name | PORICOIC-ACID-DM;16-ALPHA,25-DIHYDROXY-3,4-SECO-LANOSTA-4(28),7,9(11),24(31)-TETRAEN-3,21-DIOIC-ACID-3-METHYLESTER |
| Compound Number | 10 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H48O6 |
| InChI | InChI=1S/C32H48O6/c1-19(2)22-12-13-24-23(30(22,6)16-15-26(34)38-9)14-17-31(7)27(25(33)18-32(24,31)8)21(28(35)36)11-10-20(3)29(4,5)37/h13-14,21-22,25,27,33,37H,1,3,10-12,15-18H2,2,4-9H3,(H,35,36)/t21?,22-,25+,27-,30-,31+,32+/m0/s1 |
| InChIKey | BLNBMYVNDVNBFI-GJCLTXCZSA-N |
| Literature Reference Author | T.TAI,A.AKAHORI,T.SHINGU |
| Literature Reference Citation | PHYTOCHEM.,32,1239(1993) |
| Literature Reference DOI | 10.1016/S0031-9422(00)95099-4 |
| Molecular Weight | 528.730 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU6404 |