| SpectraBase Compound ID | BiTGZm2WzCM |
|---|---|
| InChI | InChI=1S/C48H94NO15P/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-59-38-41(60-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2)39-63-65(57,58)62-35-34-61-48(47(55)56)36-42(52)44(49-40(3)51)46(64-48)45(54)43(53)37-50/h41-46,50,52-54H,4-39H2,1-3H3,(H,49,51)(H,55,56)(H,57,58)/p-1/t41?,42-,43+,44+,45+,46-,48+/m0/s1 |
| InChIKey | QTVAVLDXGVBLCQ-MHBXVADASA-M |
| Mol Weight | 955.2 g/mol |
| Molecular Formula | C48H93NO15P |
| Exact Mass | 954.628283 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E3k9kTEnsQm |
|---|---|
| Name | (GLYCOLYL-5-ACETAMIDO-3,5-DIDEOXY-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSYL)-1,2-DIHEXADECYL-GLYCERO-3-PHOSPHATE |
| Compound Number | 2D |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H93NO15P |
| InChI | InChI=1S/C48H94NO15P/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-59-38-41(60-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2)39-63-65(57,58)62-35-34-61-48(47(55)56)36-42(52)44(49-40(3)51)46(64-48)45(54)43(53)37-50/h41-46,50,52-54H,4-39H2,1-3H3,(H,49,51)(H,55,56)(H,57,58)/p-1/t41?,42-,43+,44+,45+,46-,48+/m0/s1 |
| InChIKey | QTVAVLDXGVBLCQ-MHBXVADASA-M |
| Literature Reference Author | H.YAN,H.J.JENNINGS |
| Literature Reference Citation | CAN.J.CHEM.,84,540(2006) |
| Literature Reference DOI | 10.1139/v06-031 |
| Solvent | CDCl3:CD3OD:D2O=1:1;0 |
| Source File Reference | UWLU46786 |