![BOIVINIDE_F;COROTOXIGENIN_3-O-[BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-2-ACETYL-DIGITALOPYRANOSIDE]](/api/spectrum/4CCdeeuWHDN/structure.png?h=300&w=458 "BOIVINIDE_F;COROTOXIGENIN_3-O-[BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-2-ACETYL-DIGITALOPYRANOSIDE]")
| SpectraBase Compound ID | ERT3TZys5NR |
|---|---|
| InChI | InChI=1S/C38H56O15/c1-18-31(53-34-30(45)29(44)28(43)26(15-39)52-34)32(47-4)33(50-19(2)41)35(49-18)51-22-7-11-37(17-40)21(14-22)5-6-25-24(37)8-10-36(3)23(9-12-38(25,36)46)20-13-27(42)48-16-20/h13,17-18,21-26,28-35,39,43-46H,5-12,14-16H2,1-4H3/t18-,21+,22+,23-,24?,25?,26+,28+,29-,30+,31+,32+,33-,34-,35+,36-,37-,38+/m1/s1 |
| InChIKey | PFTYEQWDSBMMNY-NAXYJFLTSA-N |
| Mol Weight | 752.9 g/mol |
| Molecular Formula | C38H56O15 |
| Exact Mass | 752.361921 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 4CCdeeuWHDN |
|---|---|
| Name | BOIVINIDE_F;COROTOXIGENIN_3-O-[BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-2-ACETYL-DIGITALOPYRANOSIDE] |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H56O15 |
| InChI | InChI=1S/C38H56O15/c1-18-31(53-34-30(45)29(44)28(43)26(15-39)52-34)32(47-4)33(50-19(2)41)35(49-18)51-22-7-11-37(17-40)21(14-22)5-6-25-24(37)8-10-36(3)23(9-12-38(25,36)46)20-13-27(42)48-16-20/h13,17-18,21-26,28-35,39,43-46H,5-12,14-16H2,1-4H3/t18-,21+,22+,23-,24?,25?,26+,28+,29-,30+,31+,32+,33-,34-,35+,36-,37-,38+/m1/s1 |
| InChIKey | PFTYEQWDSBMMNY-NAXYJFLTSA-N |
| Literature Reference Author | S.KARKARE,E.ADOU,S.CAO,P.BRODIE,J.S.MILLER,N.M.ANDRIANJAFY,J .RAZAFITSALAMA,R.AND |
| Literature Reference Citation | J.NAT.PROD.,70,1766(2007) |
| Literature Reference DOI | 10.1021/np070336n |
| Molecular Weight | 752.854 g/mol |
| Sample ID | 31052 |
| Solvent | C5D5N |