![3-BETA,16-BETA,22-BETA,24-TETRAHYDROXY-OLEAN-12-ENE-3-BETA-YL-[BETA-D-GLUCOPYRANOSYL-(1->2)]-ALPHA-L-RHAMNOPYRANOSIDE](/api/spectrum/5y3RZ6eld5d/structure.png?h=300&w=458 "3-BETA,16-BETA,22-BETA,24-TETRAHYDROXY-OLEAN-12-ENE-3-BETA-YL-[BETA-D-GLUCOPYRANOSYL-(1->2)]-ALPHA-L-RHAMNOPYRANOSIDE")
| SpectraBase Compound ID | 1DuRBEUgR8U |
|---|---|
| InChI | InChI=1S/C42H70O13/c1-20-29(47)32(50)34(55-35-33(51)31(49)30(48)23(18-43)53-35)36(52-20)54-28-12-13-38(4)24(39(28,5)19-44)11-14-40(6)25(38)10-9-21-22-15-37(2,3)16-26(45)42(22,8)27(46)17-41(21,40)7/h9,20,22-36,43-51H,10-19H2,1-8H3/t20-,22-,23+,24+,25+,26+,27-,28-,29-,30+,31-,32+,33+,34+,35-,36-,38-,39+,40+,41+,42+/m0/s1 |
| InChIKey | QLMREUCQBUANIZ-WSSGPZJOSA-N |
| Mol Weight | 783.0 g/mol |
| Molecular Formula | C42H70O13 |
| Exact Mass | 782.481642 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5y3RZ6eld5d |
|---|---|
| Name | 3-BETA,16-BETA,22-BETA,24-TETRAHYDROXY-OLEAN-12-ENE-3-BETA-YL-[BETA-D-GLUCOPYRANOSYL-(1->2)]-ALPHA-L-RHAMNOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H70O13 |
| InChI | InChI=1S/C42H70O13/c1-20-29(47)32(50)34(55-35-33(51)31(49)30(48)23(18-43)53-35)36(52-20)54-28-12-13-38(4)24(39(28,5)19-44)11-14-40(6)25(38)10-9-21-22-15-37(2,3)16-26(45)42(22,8)27(46)17-41(21,40)7/h9,20,22-36,43-51H,10-19H2,1-8H3/t20-,22-,23+,24+,25+,26+,27-,28-,29-,30+,31-,32+,33+,34+,35-,36-,38-,39+,40+,41+,42+/m0/s1 |
| InChIKey | QLMREUCQBUANIZ-WSSGPZJOSA-N |
| Literature Reference Author | A.R.BILIA,F.FLAMMINI,G.FLAMINI,I.MORELLI,A.MARSILI |
| Literature Reference Citation | PHYTOCHEM.,34,847(1993) |
| Literature Reference DOI | 10.1016/0031-9422(93)85371-W |
| Molecular Weight | 783.010 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN6813 |