| SpectraBase Compound ID | 7UUEkKwS0QJ |
|---|---|
| InChI | InChI=1S/C31H46O7/c1-8-17(3)26(34)36-23-24-28(6)13-11-21(33)16-20(28)10-14-30(24)31(38-30)15-12-22(19(5)32)29(31,7)25(23)37-27(35)18(4)9-2/h9,17,20-25,33H,8,10-16H2,1-7H3/b18-9+/t17?,20-,21-,22-,23-,24+,25+,28-,29-,30-,31+/m0/s1 |
| InChIKey | JTKBITJOQABWTF-ADNXDBCMSA-N |
| Mol Weight | 530.7 g/mol |
| Molecular Formula | C31H46O7 |
| Exact Mass | 530.324354 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ha0VVRikal9 |
|---|---|
| Name | 11-ALPHA-2-METHYLBUTANOYL-12-BETA-O-TIGLOYL-TENACIGENIN-B |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H46O7 |
| InChI | InChI=1S/C31H46O7/c1-8-17(3)26(34)36-23-24-28(6)13-11-21(33)16-20(28)10-14-30(24)31(38-30)15-12-22(19(5)32)29(31,7)25(23)37-27(35)18(4)9-2/h9,17,20-25,33H,8,10-16H2,1-7H3/b18-9+/t17?,20-,21-,22-,23-,24+,25+,28-,29-,30-,31+/m0/s1 |
| InChIKey | JTKBITJOQABWTF-ADNXDBCMSA-N |
| Literature Reference Author | R.J.ZHU,X.L.SHEN,L.L.DAI,X.Y.AI,R.H.TIAN,R.TANG,Y.J.HU |
| Literature Reference Citation | MOLECULES,19,13965(2014) |
| Literature Reference DOI | 10.3390/molecules190913965 |
| Molecular Weight | 530.702 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWIR15346 |