| SpectraBase Compound ID | GzZlLK9veWg |
|---|---|
| InChI | InChI=1S/C48H78O20/c1-20-9-12-48(43(62)68-42-38(61)35(58)32(55)26(66-42)18-63-40-36(59)33(56)30(53)24(16-49)64-40)14-13-46(5)22(29(48)21(20)2)7-8-28-44(3)15-23(52)39(45(4,19-51)27(44)10-11-47(28,46)6)67-41-37(60)34(57)31(54)25(17-50)65-41/h7,20-21,23-42,49-61H,8-19H2,1-6H3/t20-,21+,23-,24-,25-,26-,27-,28-,29+,30-,31-,32-,33+,34+,35+,36-,37-,38-,39+,40-,41+,42+,44+,45+,46-,47-,48+/m1/s1 |
| InChIKey | OHIYCAUHGBJQAI-MSUNJOLVSA-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 | 76qmUZ8IDTy |
|---|---|
| Name | STELMATOTRITERPENOSIDE-F;#2;2-ALPHA,3-BETA,23-TRIHYDROXY-URS-12-EN-28-OIC-ACID-3-O-BETA-D-GLUCOPYRANOSYL-28-O-BETA-D-GLUCOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSY |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H78O20 |
| InChI | InChI=1S/C48H78O20/c1-20-9-12-48(43(62)68-42-38(61)35(58)32(55)26(66-42)18-63-40-36(59)33(56)30(53)24(16-49)64-40)14-13-46(5)22(29(48)21(20)2)7-8-28-44(3)15-23(52)39(45(4,19-51)27(44)10-11-47(28,46)6)67-41-37(60)34(57)31(54)25(17-50)65-41/h7,20-21,23-42,49-61H,8-19H2,1-6H3/t20-,21+,23-,24-,25-,26-,27-,28-,29+,30-,31-,32-,33+,34+,35+,36-,37-,38-,39+,40-,41+,42+,44+,45+,46-,47-,48+/m1/s1 |
| InChIKey | OHIYCAUHGBJQAI-MSUNJOLVSA-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 | UWMS21396 |