| SpectraBase Compound ID | AJEpgWcgTBz |
|---|---|
| InChI | InChI=1S/C36H58O11/c1-18-9-12-36(30(44)47-29-26(42)25(41)24(40)21(16-37)46-29)14-13-33(4)19(27(36)35(18,6)45)7-8-23-31(2)15-20(39)28(43)32(3,17-38)22(31)10-11-34(23,33)5/h7,18,20-29,37-43,45H,8-17H2,1-6H3/t18-,20-,21-,22?,23?,24-,25+,26-,27?,28+,29+,31+,32+,33-,34-,35-,36+/m0/s1 |
| InChIKey | WKKBYJLXSKPKSC-KIHHWTKVSA-N |
| Mol Weight | 666.8 g/mol |
| Molecular Formula | C36H58O11 |
| Exact Mass | 666.397913 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CYFI3XZj5fK |
|---|---|
| Name | 23-HYDROXYTORMENTIC ACID 28-O-beta-D-GLUCOPYRANOSIDE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C36H58O11 |
| InChI | InChI=1S/C36H58O11/c1-18-9-12-36(30(44)47-29-26(42)25(41)24(40)21(16-37)46-29)14-13-33(4)19(27(36)35(18,6)45)7-8-23-31(2)15-20(39)28(43)32(3,17-38)22(31)10-11-34(23,33)5/h7,18,20-29,37-43,45H,8-17H2,1-6H3/t18-,20-,21-,22?,23?,24-,25+,26-,27?,28+,29+,31+,32+,33-,34-,35-,36+/m0/s1 |
| InChIKey | WKKBYJLXSKPKSC-KIHHWTKVSA-N |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |