| SpectraBase Compound ID | kSsp7LBjBU |
|---|---|
| InChI | InChI=1S/C30H52O12/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(33)39-19-20(32)27-26(37)28(29(38)41-27)42-30-25(36)24(35)23(34)21(18-31)40-30/h20-21,23-25,27,30-32,34-37H,2-19H2,1H3/t20-,21+,23+,24-,25+,27-,30+/m1/s1 |
| InChIKey | YSRSXOSECMVEAH-LZDMVLGXSA-N |
| Mol Weight | 604.7 g/mol |
| Molecular Formula | C30H52O12 |
| Exact Mass | 604.345877 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LbuvWxRvbVP |
|---|---|
| Name | 2-O-ALPHA-D-GLUCOPYRANOSYL-6-O-OCTADECANOYL-L-ASCORBIC-ACID |
| Compound Number | 6-STEA-AA-2G |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H52O12 |
| InChI | InChI=1S/C30H52O12/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(33)39-19-20(32)27-26(37)28(29(38)41-27)42-30-25(36)24(35)23(34)21(18-31)40-30/h20-21,23-25,27,30-32,34-37H,2-19H2,1H3/t20-,21+,23+,24-,25+,27-,30+/m1/s1 |
| InChIKey | YSRSXOSECMVEAH-LZDMVLGXSA-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 | 604.736 g/mol |
| Sample ID | 64231 |
| Solvent | DMSO-D6 |