![3-O-BETA-D-GLUCURONOPYRANOSYL-21-O-[(S)-(+)-2-METHYLBUTYLOYL]-28-O-ACETYL-GYMNEMAGENIN;GYMNEMIC-ACID-2](/api/spectrum/7RcZRBPrKTl/structure.png?h=300&w=458 "3-O-BETA-D-GLUCURONOPYRANOSYL-21-O-[(S)-(+)-2-METHYLBUTYLOYL]-28-O-ACETYL-GYMNEMAGENIN;GYMNEMIC-ACID-2")
| SpectraBase Compound ID | 3FTDmBMzqOl |
|---|---|
| InChI | InChI=1S/C43H68O14/c1-10-21(2)36(53)57-34-33(50)43(20-54-22(3)45)24(17-38(34,4)5)23-11-12-26-39(6)15-14-28(55-37-31(49)29(47)30(48)32(56-37)35(51)52)40(7,19-44)25(39)13-16-41(26,8)42(23,9)18-27(43)46/h11,21,24-34,37,44,46-50H,10,12-20H2,1-9H3,(H,51,52)/t21?,24?,25?,26?,27-,28-,29-,30-,31+,32-,33-,34-,37+,39-,40-,41+,42+,43-/m0/s1 |
| InChIKey | IWLKKMZNFBKYCF-ZVJOEZINSA-N |
| Mol Weight | 809.0 g/mol |
| Molecular Formula | C43H68O14 |
| Exact Mass | 808.460907 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7RcZRBPrKTl |
|---|---|
| Name | 3-O-BETA-D-GLUCURONOPYRANOSYL-21-O-[(S)-(+)-2-METHYLBUTYLOYL]-28-O-ACETYL-GYMNEMAGENIN;GYMNEMIC-ACID-2 |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H68O14 |
| InChI | InChI=1S/C43H68O14/c1-10-21(2)36(53)57-34-33(50)43(20-54-22(3)45)24(17-38(34,4)5)23-11-12-26-39(6)15-14-28(55-37-31(49)29(47)30(48)32(56-37)35(51)52)40(7,19-44)25(39)13-16-41(26,8)42(23,9)18-27(43)46/h11,21,24-34,37,44,46-50H,10,12-20H2,1-9H3,(H,51,52)/t21?,24?,25?,26?,27-,28-,29-,30-,31+,32-,33-,34-,37+,39-,40-,41+,42+,43-/m0/s1 |
| InChIKey | IWLKKMZNFBKYCF-ZVJOEZINSA-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 | 809.005 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWCS9994 |