![YUANHUALINE;6-ALPHA,7-ALPHA-EPOXY-5-BETA-HYDROXY-9,13,14-ORTHO-[(2E,4E)-DECA-2,4-DIEN-1-YL]-RESINIFERONOL-12-BETA-YL-BUTANOATE](/api/spectrum/4KIdjb0mT9y/structure.png?h=300&w=458 "YUANHUALINE;6-ALPHA,7-ALPHA-EPOXY-5-BETA-HYDROXY-9,13,14-ORTHO-[(2E,4E)-DECA-2,4-DIEN-1-YL]-RESINIFERONOL-12-BETA-YL-BUTANOATE")
| SpectraBase Compound ID | APKzaK4jOpO |
|---|---|
| InChI | InChI=1S/C34H46O10/c1-7-9-10-11-12-13-14-16-31-42-28-24-27-30(18-35,41-27)29(38)32(39)22(17-20(5)25(32)37)34(24,44-31)21(6)26(40-23(36)15-8-2)33(28,43-31)19(3)4/h12-14,16-17,21-22,24,26-29,35,38-39H,3,7-11,15,18H2,1-2,4-6H3/b13-12+,16-14+/t21-,22-,24+,26-,27+,28-,29-,30+,31-,32-,33+,34+/m1/s1 |
| InChIKey | ZDLZTEOSMQFTTO-IOKPFFQBSA-N |
| Mol Weight | 614.7 g/mol |
| Molecular Formula | C34H46O10 |
| Exact Mass | 614.309098 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4KIdjb0mT9y |
|---|---|
| Name | YUANHUALINE;6-ALPHA,7-ALPHA-EPOXY-5-BETA-HYDROXY-9,13,14-ORTHO-[(2E,4E)-DECA-2,4-DIEN-1-YL]-RESINIFERONOL-12-BETA-YL-BUTANOATE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H46O10 |
| InChI | InChI=1S/C34H46O10/c1-7-9-10-11-12-13-14-16-31-42-28-24-27-30(18-35,41-27)29(38)32(39)22(17-20(5)25(32)37)34(24,44-31)21(6)26(40-23(36)15-8-2)33(28,43-31)19(3)4/h12-14,16-17,21-22,24,26-29,35,38-39H,3,7-11,15,18H2,1-2,4-6H3/b13-12+,16-14+/t21-,22-,24+,26-,27+,28-,29-,30+,31-,32-,33+,34+/m1/s1 |
| InChIKey | ZDLZTEOSMQFTTO-IOKPFFQBSA-N |
| Literature Reference Author | J.Y.HONG,J.W.NAM,E.K.SEO,S.K.LEE |
| Literature Reference Citation | CHEM.PHARM.BULL.,58,234(2010) |
| Literature Reference DOI | 10.1248/cpb.58.234 |
| Molecular Weight | 614.733 g/mol |
| Sample ID | 3376 |
| Solvent | CDCl3:CD3OD |