| SpectraBase Compound ID | 6xexEy8Tumk |
|---|---|
| InChI | InChI=1S/C31H52O4/c1-26(2,34)19-12-16-28(4)23-11-10-22-27(3)14-9-15-29(5,25(33)35-8)21(27)13-17-30(22,6)31(23,7)18-20(32)24(19)28/h19-24,32,34H,9-18H2,1-8H3/t19-,20-,21+,22+,23+,24+,27-,28+,29+,30+,31+/m0/s1 |
| InChIKey | AGKSQUKIWQTFHZ-PVJTYMEXSA-N |
| Mol Weight | 488.8 g/mol |
| Molecular Formula | C31H52O4 |
| Exact Mass | 488.38656 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | lGeL3hHB7o |
|---|---|
| Name | METHYL-16-BETA,22-DIHYDROXY-17-BETA-H-HOP-23-OATE |
| Compound Number | 343 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H52O4 |
| InChI | InChI=1S/C31H52O4/c1-26(2,34)19-12-16-28(4)23-11-10-22-27(3)14-9-15-29(5,25(33)35-8)21(27)13-17-30(22,6)31(23,7)18-20(32)24(19)28/h19-24,32,34H,9-18H2,1-8H3/t19-,20-,21+,22+,23+,24+,27-,28+,29+,30+,31+/m0/s1 |
| InChIKey | AGKSQUKIWQTFHZ-PVJTYMEXSA-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 | 488.751 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS5443 |