| SpectraBase Compound ID | 2tbhPNr337J |
|---|---|
| InChI | InChI=1S/C18H28O12/c1-2-3-4-5-10(21)27-7-8(20)15-14(25)16(17(26)29-15)30-18-13(24)12(23)11(22)9(6-19)28-18/h8-9,11-13,15,18-20,22-25H,2-7H2,1H3/t8-,9+,11+,12-,13+,15-,18+/m1/s1 |
| InChIKey | JTTLAQQOSBAEMS-UOQOAKTBSA-N |
| Mol Weight | 436.41 g/mol |
| Molecular Formula | C18H28O12 |
| Exact Mass | 436.158076 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BrZvrKPgw9D |
|---|---|
| Name | 2-O-ALPHA-D-GLUCOPYRANOSYL-6-O-HEXANOYL-L-ASCORBIC-ACID |
| Compound Number | 6-HEXA-AA-2G |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C18H28O12 |
| InChI | InChI=1S/C18H28O12/c1-2-3-4-5-10(21)27-7-8(20)15-14(25)16(17(26)29-15)30-18-13(24)12(23)11(22)9(6-19)28-18/h8-9,11-13,15,18-20,22-25H,2-7H2,1H3/t8-,9+,11+,12-,13+,15-,18+/m1/s1 |
| InChIKey | JTTLAQQOSBAEMS-UOQOAKTBSA-N |
| Literature Reference Author | I.YAMAMOTO,A.TAI,Y.FUJINAMI,K.SASAKI,S.OKAZAKI |
| Literature Reference Citation | J.MED.CHEM.,45,462(2002) |
| Literature Reference DOI | 10.1021/jm010379f |
| Molecular Weight | 436.413 g/mol |
| Sample ID | 64225 |
| Solvent | CD3OD |