| SpectraBase Compound ID | A2ExigGLaZd |
|---|---|
| InChI | InChI=1S/C35H48O14/c1-16-9-25(48-30-29(41)28(40)27(39)24(13-36)46-30)35(43)31(45-16)47-22-11-18-3-4-21-20(33(18,15-37)12-23(22)49-35)5-7-32(2)19(6-8-34(21,32)42)17-10-26(38)44-14-17/h3,10,15-16,19-25,27-31,36,39-43H,4-9,11-14H2,1-2H3/t16-,19-,20+,21+,22?,23-,24+,25+,27+,28-,29+,30-,31+,32-,33-,34+,35+/m1/s1 |
| InChIKey | ZNURLGCTNWVTID-WIOWDNQESA-N |
| Mol Weight | 692.8 g/mol |
| Molecular Formula | C35H48O14 |
| Exact Mass | 692.304406 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 | 5XdxJNPsslu |
|---|---|
| Name | DELTA-(5)-CALOTROPIN-3'-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H48O14 |
| InChI | InChI=1S/C35H48O14/c1-16-9-25(48-30-29(41)28(40)27(39)24(13-36)46-30)35(43)31(45-16)47-22-11-18-3-4-21-20(33(18,15-37)12-23(22)49-35)5-7-32(2)19(6-8-34(21,32)42)17-10-26(38)44-14-17/h3,10,15-16,19-25,27-31,36,39-43H,4-9,11-14H2,1-2H3/t16-,19-,20+,21+,22?,23-,24+,25+,27+,28-,29+,30-,31+,32-,33-,34+,35+/m1/s1 |
| InChIKey | ZNURLGCTNWVTID-WIOWDNQESA-N |
| Literature Reference Author | F.ABE,T.YAMAUCHI |
| Literature Reference Citation | CHEM.PHARM.BULL.,48,991(2000) |
| Literature Reference DOI | 10.1248/cpb.48.991 |
| Molecular Weight | 692.758 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN4335 |