| SpectraBase Compound ID | uUKUqeeth5 |
|---|---|
| InChI | InChI=1S/C25H22O12/c26-14-2-1-9(4-15(14)27)20-12-8-17(29)16(28)5-10(12)3-13(21(20)24(34)35)25(36)37-19-7-11(23(32)33)6-18(30)22(19)31/h1-6,8,18-22,26-31H,7H2,(H,32,33)(H,34,35)/t18-,19-,20?,21?,22-/m1/s1 |
| InChIKey | LZDRVVOIQKWKHP-WWOKZEJKSA-N |
| Mol Weight | 514.44 g/mol |
| Molecular Formula | C25H22O12 |
| Exact Mass | 514.111126 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DfgWGeA3nvH |
|---|---|
| Name | 2,3-DICARBOXY-6,7-DIHYDROXY-1-(3',4'-DIHYDROXY)-PHENYL-1,2-DIHYDRONAPHTHALENE-9,5''-O-SHIKIMIC ACID ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C25H22O12 |
| InChI | InChI=1S/C25H22O12/c26-14-2-1-9(4-15(14)27)20-12-8-17(29)16(28)5-10(12)3-13(21(20)24(34)35)25(36)37-19-7-11(23(32)33)6-18(30)22(19)31/h1-6,8,18-22,26-31H,7H2,(H,32,33)(H,34,35)/t18-,19-,20?,21?,22-/m1/s1 |
| InChIKey | LZDRVVOIQKWKHP-WWOKZEJKSA-N |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |