| SpectraBase Compound ID | GG0Qi5gofAi |
|---|---|
| InChI | InChI=1S/C48H78O20/c1-43(2)11-13-48(42(62)68-41-37(61)34(58)31(55)26(66-41)19-63-39-35(59)32(56)29(53)24(17-49)64-39)14-12-46(5)21(22(48)15-43)7-8-28-44(3)16-23(52)38(45(4,20-51)27(44)9-10-47(28,46)6)67-40-36(60)33(57)30(54)25(18-50)65-40/h7,22-41,49-61H,8-20H2,1-6H3/t22-,23+,24+,25+,26+,27+,28+,29+,30+,31+,32-,33-,34-,35+,36+,37+,38-,39+,40-,41-,44-,45-,46+,47+,48-/m0/s1 |
| InChIKey | UAUGNOZZMKTWJB-RQCWFEANSA-N |
| Mol Weight | 975.1 g/mol |
| Molecular Formula | C48H78O20 |
| Exact Mass | 974.508645 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 90GIlt1PXkd |
|---|---|
| Name | STELMATOTRITERPENOSIDE-E;#1;2-ALPHA,3-BETA,23-TRIHYDROXY-OLEAN-12-EN-28-OIC-ACID-3-O-BETA-D-GLUCOPYRANOSYL-28-O-BETA-D-GLUCOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANO |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H78O20 |
| InChI | InChI=1S/C48H78O20/c1-43(2)11-13-48(42(62)68-41-37(61)34(58)31(55)26(66-41)19-63-39-35(59)32(56)29(53)24(17-49)64-39)14-12-46(5)21(22(48)15-43)7-8-28-44(3)16-23(52)38(45(4,20-51)27(44)9-10-47(28,46)6)67-40-36(60)33(57)30(54)25(18-50)65-40/h7,22-41,49-61H,8-20H2,1-6H3/t22-,23+,24+,25+,26+,27+,28+,29+,30+,31+,32-,33-,34-,35+,36+,37+,38-,39+,40-,41-,44-,45-,46+,47+,48-/m0/s1 |
| InChIKey | UAUGNOZZMKTWJB-RQCWFEANSA-N |
| Literature Reference Author | Q.ZHANG,Y.ZHAO,B.WANG,G.TU |
| Literature Reference Citation | CHEM.PHARM.BULL.,51,574(2003) |
| Literature Reference DOI | 10.1248/cpb.51.574 |
| Molecular Weight | 975.135 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS21395 |