| SpectraBase Compound ID | 5Qucj9mfeuO |
|---|---|
| InChI | InChI=1S/C48H78O21/c1-43(2)11-13-48(42(63)69-40-34(60)32(58)29(55)23(17-50)65-40)14-12-46(5)20(27(48)37(43)62)7-8-26-44(3)15-21(53)38(45(4,19-52)25(44)9-10-47(26,46)6)68-41-35(61)36(30(56)24(18-51)66-41)67-39-33(59)31(57)28(54)22(16-49)64-39/h7,21-41,49-62H,8-19H2,1-6H3/t21-,22-,23-,24-,25-,26-,27-,28+,29-,30-,31+,32+,33-,34-,35-,36+,37+,38+,39+,40+,41+,44+,45+,46-,47-,48+/m1/s1 |
| InChIKey | NSZSDRNMXRQQMG-DAEXLSCLSA-N |
| Mol Weight | 991.1 g/mol |
| Molecular Formula | C48H78O21 |
| Exact Mass | 990.50356 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 98UnsMS792P |
|---|---|
| Name | 2-ALPHA,3-BETA,19-BETA,23-TETRAHYDROXY-OLEAN-12-EN-28-OIC-ACID-3-O-BETA-D-GALACTOPYRANOSYL-(1->3)-BETA-D-GLUCOPYRANOSYL-28-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H78O21 |
| InChI | InChI=1S/C48H78O21/c1-43(2)11-13-48(42(63)69-40-34(60)32(58)29(55)23(17-50)65-40)14-12-46(5)20(27(48)37(43)62)7-8-26-44(3)15-21(53)38(45(4,19-52)25(44)9-10-47(26,46)6)68-41-35(61)36(30(56)24(18-51)66-41)67-39-33(59)31(57)28(54)22(16-49)64-39/h7,21-41,49-62H,8-19H2,1-6H3/t21-,22-,23-,24-,25-,26-,27-,28+,29-,30-,31+,32+,33-,34-,35-,36+,37+,38+,39+,40+,41+,44+,45+,46-,47-,48+/m1/s1 |
| InChIKey | NSZSDRNMXRQQMG-DAEXLSCLSA-N |
| Literature Reference Author | S.K.SRIVASTAVA,S.D.SRIVASTAVA,B.K.CHOUKSEY |
| Literature Reference Citation | FITOTERAPIA,72,106(2001) |
| Literature Reference DOI | 10.1016/S0367-326X(00)00261-6 |
| Molecular Weight | 991.135 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN3933 |