| SpectraBase Compound ID | 4CRKtZ0agti |
|---|---|
| InChI | InChI=1S/C16H28O7/c1-5-16(4,8-6-7-9(2)14(20)21)23-15-13(19)12(18)11(17)10(3)22-15/h5,9-13,15,17-19H,1,6-8H2,2-4H3,(H,20,21)/t9?,10-,11-,12+,13-,15?,16+/m0/s1 |
| InChIKey | RMLMMXWVQHEIFK-QEWMGTMXSA-N |
| Mol Weight | 332.39 g/mol |
| Molecular Formula | C16H28O7 |
| Exact Mass | 332.183503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AmAmbHEu2nd |
|---|---|
| Name | 6S-2,6-DIMETHYL-6-O-BETA-D-QUINOVOPYRANOSYL-7-OCTAENOIC-ACID |
| Compound Number | 9A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C16H28O7 |
| InChI | InChI=1S/C16H28O7/c1-5-16(4,8-6-7-9(2)14(20)21)23-15-13(19)12(18)11(17)10(3)22-15/h5,9-13,15,17-19H,1,6-8H2,2-4H3,(H,20,21)/t9?,10-,11-,12+,13-,15?,16+/m0/s1 |
| InChIKey | RMLMMXWVQHEIFK-QEWMGTMXSA-N |
| Literature Reference Author | K.YOSHIKAWA,Y.SATOU,Y.TOKUNAGA,M.TANAKA,S.ARIHARA,S.K.NIGAM |
| Literature Reference Citation | J.NAT.PROD.,61,440(1998) |
| Literature Reference DOI | 10.1021/np970538r |
| Molecular Weight | 332.394 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWCP972 |