![(E)-2-DEOXY-ECDYSONE-3-[4-(1-BETA-D-GLUCOPYRANOSYL)]-FERULATE](/api/spectrum/BF5WUE2211x/structure.png?h=300&w=458 "(E)-2-DEOXY-ECDYSONE-3-[4-(1-BETA-D-GLUCOPYRANOSYL)]-FERULATE")
| SpectraBase Compound ID | EWnC53OI8wh |
|---|---|
| InChI | InChI=1S/C43H62O13/c1-23(30(45)14-15-40(2,3)51)26-13-18-43(52)28-21-31(46)29-20-25(11-16-41(29,4)27(28)12-17-42(26,43)5)54-35(47)10-8-24-7-9-32(33(19-24)53-6)55-39-38(50)37(49)36(48)34(22-44)56-39/h7-10,19,21,23,25-27,29-30,34,36-39,44-45,48-52H,11-18,20,22H2,1-6H3/b10-8+/t23-,25-,26+,27-,29-,30+,34-,36-,37+,38-,39-,41+,42+,43+/m0/s1 |
| InChIKey | KAQKBWAFKZDSON-JGJOVSFISA-N |
| Mol Weight | 787.0 g/mol |
| Molecular Formula | C43H62O13 |
| Exact Mass | 786.419042 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BF5WUE2211x |
|---|---|
| Name | (E)-2-DEOXY-ECDYSONE-3-[4-(1-BETA-D-GLUCOPYRANOSYL)]-FERULATE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H62O13 |
| InChI | InChI=1S/C43H62O13/c1-23(30(45)14-15-40(2,3)51)26-13-18-43(52)28-21-31(46)29-20-25(11-16-41(29,4)27(28)12-17-42(26,43)5)54-35(47)10-8-24-7-9-32(33(19-24)53-6)55-39-38(50)37(49)36(48)34(22-44)56-39/h7-10,19,21,23,25-27,29-30,34,36-39,44-45,48-52H,11-18,20,22H2,1-6H3/b10-8+/t23-,25-,26+,27-,29-,30+,34-,36-,37+,38-,39-,41+,42+,43+/m0/s1 |
| InChIKey | KAQKBWAFKZDSON-JGJOVSFISA-N |
| Literature Reference Author | R.HO,J.P.GIRAULT,P.RAHARIVELOMANANA,R.LAFONT |
| Literature Reference Citation | MOLECULES,17,11598(2012) |
| Literature Reference DOI | 10.3390/molecules171011598 |
| Molecular Weight | 786.957 g/mol |
| Sample ID | 826 |
| Solvent | CD3OD |