![3-O-BETA-D-GLUCURONOPYRANOSYL-21-O-[(S)-(+)-2-METHYLBUTYLOYL]-GYMNEMAGENIN;GYMNEMIC-ACID-3](/api/spectrum/bVS4oKFUO/structure.png?h=300&w=458 "3-O-BETA-D-GLUCURONOPYRANOSYL-21-O-[(S)-(+)-2-METHYLBUTYLOYL]-GYMNEMAGENIN;GYMNEMIC-ACID-3")
| SpectraBase Compound ID | 4mleajuCMsb |
|---|---|
| InChI | InChI=1S/C41H66O13/c1-9-20(2)34(51)54-32-31(48)41(19-43)22(16-36(32,3)4)21-10-11-24-37(5)14-13-26(52-35-29(47)27(45)28(46)30(53-35)33(49)50)38(6,18-42)23(37)12-15-39(24,7)40(21,8)17-25(41)44/h10,20,22-32,35,42-48H,9,11-19H2,1-8H3,(H,49,50)/t20?,22?,23?,24?,25-,26-,27-,28-,29+,30-,31-,32-,35+,37-,38-,39+,40+,41-/m0/s1 |
| InChIKey | VLXWTKUXVXJELF-XYCATQATSA-N |
| Mol Weight | 767.0 g/mol |
| Molecular Formula | C41H66O13 |
| Exact Mass | 766.450342 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | bVS4oKFUO |
|---|---|
| Name | 3-O-BETA-D-GLUCURONOPYRANOSYL-21-O-[(S)-(+)-2-METHYLBUTYLOYL]-GYMNEMAGENIN;GYMNEMIC-ACID-3 |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H66O13 |
| InChI | InChI=1S/C41H66O13/c1-9-20(2)34(51)54-32-31(48)41(19-43)22(16-36(32,3)4)21-10-11-24-37(5)14-13-26(52-35-29(47)27(45)28(46)30(53-35)33(49)50)38(6,18-42)23(37)12-15-39(24,7)40(21,8)17-25(41)44/h10,20,22-32,35,42-48H,9,11-19H2,1-8H3,(H,49,50)/t20?,22?,23?,24?,25-,26-,27-,28-,29+,30-,31-,32-,35+,37-,38-,39+,40+,41-/m0/s1 |
| InChIKey | VLXWTKUXVXJELF-XYCATQATSA-N |
| Literature Reference Author | K.YOSHIKAWA,K.AMIMOTO,S.ARIHARA,K.MATSUURA |
| Literature Reference Citation | TETRAH.LETT.,30,1103(1989) |
| Literature Reference DOI | 10.1016/S0040-4039(01)80371-3 |
| Molecular Weight | 766.967 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWCS9995 |