| SpectraBase Compound ID | 3tbvOcfXG8t |
|---|---|
| InChI | InChI=1S/C32H48O5/c1-19-11-14-32(26(34)35)16-15-28(5)22(25(32)31(19,8)36)9-10-24-29(28,6)13-12-23-27(3,4)17-21(30(23,24)7)18-37-20(2)33/h9,17,19,23-25,36H,10-16,18H2,1-8H3,(H,34,35)/t19-,23+,24+,25-,28+,29-,30+,31-,32+/m1/s1 |
| InChIKey | AXXUECGGIVEUQY-BSUICFKCSA-N |
| Mol Weight | 512.7 g/mol |
| Molecular Formula | C32H48O5 |
| Exact Mass | 512.350175 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KewDNoMWe9V |
|---|---|
| Name | COLEONIC-ACID-MONOACETATE |
| Compound Number | 249 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H48O5 |
| InChI | InChI=1S/C32H48O5/c1-19-11-14-32(26(34)35)16-15-28(5)22(25(32)31(19,8)36)9-10-24-29(28,6)13-12-23-27(3,4)17-21(30(23,24)7)18-37-20(2)33/h9,17,19,23-25,36H,10-16,18H2,1-8H3,(H,34,35)/t19-,23+,24+,25-,28+,29-,30+,31-,32+/m1/s1 |
| InChIKey | AXXUECGGIVEUQY-BSUICFKCSA-N |
| Literature Reference Author | S.B.MAHATO,A.P.KUNDU |
| Literature Reference Citation | PHYTOCHEM.,37,1517(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)89569-2 |
| Molecular Weight | 512.730 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS5349 |