| SpectraBase Compound ID | 75tNY412vGb |
|---|---|
| InChI | InChI=1S/C42H68O15/c1-19-28(47)30(49)32(51)35(54-19)57-33-31(50)29(48)23(18-43)55-36(33)56-27-13-11-21-20(38(27,4)5)10-12-24-39(6)16-22(44)34(40(39,7)17-26(46)41(21,24)8)42(9,53)25(45)14-15-37(2,3)52/h10,14-15,19,21-25,27-36,43-45,47-53H,11-13,16-18H2,1-9H3/b15-14+/t19-,21+,22+,23+,24-,25-,27+,28-,29+,30+,31-,32+,33+,34-,35-,36-,39-,40+,41-,42?/m0/s1 |
| InChIKey | JJNGJQDTXWNKKW-YMIUTHFWSA-N |
| Mol Weight | 813.0 g/mol |
| Molecular Formula | C42H68O15 |
| Exact Mass | 812.455821 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 | 2RAY5mZs4uX |
|---|---|
| Name | (22S)-16-ALPHA,20,22,25-TETRAHYDROXY-3-ALPHA-(2-O-ALPHA-L-RHAMNOPYRANOSYL-BETA-D-GLUCOPYRANOSYLOXY)-(10-ALPHA)-CUCURBITA-5,23T-DIEN-11-ONE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H68O15 |
| InChI | InChI=1S/C42H68O15/c1-19-28(47)30(49)32(51)35(54-19)57-33-31(50)29(48)23(18-43)55-36(33)56-27-13-11-21-20(38(27,4)5)10-12-24-39(6)16-22(44)34(40(39,7)17-26(46)41(21,24)8)42(9,53)25(45)14-15-37(2,3)52/h10,14-15,19,21-25,27-36,43-45,47-53H,11-13,16-18H2,1-9H3/b15-14+/t19-,21+,22+,23+,24-,25-,27+,28-,29+,30+,31-,32+,33+,34-,35-,36-,39-,40+,41-,42?/m0/s1 |
| InChIKey | JJNGJQDTXWNKKW-YMIUTHFWSA-N |
| Literature Reference Author | H.ACHENBACH,K.HORN,X.A.DOMINGUEZ,C.ROMBOLD,E.G.G.LOPEZ |
| Literature Reference Citation | PHYTOCHEM.,33,437(1993) |
| Literature Reference DOI | 10.1016/0031-9422(93)85535-Y |
| Molecular Weight | 812.993 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVN6410 |