| SpectraBase Compound ID | 9obmPNVP6GI |
|---|---|
| InChI | InChI=1S/2C30H38NO16P/c2*1-17(32)43-16-22-25(44-18(2)33)26(45-19(3)34)24(31-27(35)20-12-9-10-13-21(20)28(31)36)29(46-22)42-15-11-7-8-14-23(47-30(37)39-4)48(38,40-5)41-6/h2*8-10,12-14,22-26,29H,7,11,15-16H2,1-6H3/b2*14-8+/t22-,23+,24-,25-,26-,29-;22-,23-,24-,25-,26-,29-/m11/s1 |
| InChIKey | IRJOKAJNAAHGOG-FMKDABNISA-N |
| Mol Weight | 1399.2 g/mol |
| Molecular Formula | C60H76N2O32P2 |
| Exact Mass | 1398.385642 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CWyu4RtXQrx |
|---|---|
| Name | IRJOKAJNAAHGOG-FMKDABNISA-N |
| Compound Number | 3O |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C60H76N2O32P2 |
| InChI | InChI=1S/2C30H38NO16P/c2*1-17(32)43-16-22-25(44-18(2)33)26(45-19(3)34)24(31-27(35)20-12-9-10-13-21(20)28(31)36)29(46-22)42-15-11-7-8-14-23(47-30(37)39-4)48(38,40-5)41-6/h2*8-10,12-14,22-26,29H,7,11,15-16H2,1-6H3/b2*14-8+/t22-,23+,24-,25-,26-,29-;22-,23-,24-,25-,26-,29-/m11/s1 |
| InChIKey | IRJOKAJNAAHGOG-FMKDABNISA-N |
| Literature Reference Author | A.HE,B.YAN,A.THANAVARO,C.D.SPILLING,N.P.RATH |
| Literature Reference Citation | J.ORG.CHEM.,69,8643(2004) |
| Literature Reference DOI | 10.1021/jo0490090 |
| Molecular Weight | 1399.205 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN22957 |