| SpectraBase Compound ID | 60WbiuiSQ9q |
|---|---|
| InChI | InChI=1S/C35H42O18/c1-13-22(46-15(3)37)10-20-21(11-45-32(42)24(13)20)31(41)51-26-19-8-9-43-33(25(19)35(7)30(26)53-35)52-34-29(49-18(6)40)28(48-17(5)39)27(47-16(4)38)23(50-34)12-44-14(2)36/h8-9,19-23,25-30,33-34H,10-12H2,1-7H3/t19-,20?,21?,22?,23+,25-,26+,27+,28-,29+,30+,33+,34-,35-/m1/s1 |
| InChIKey | TUBDCFRIILXFON-BPOMVFCOSA-N |
| Mol Weight | 750.7 g/mol |
| Molecular Formula | C35H42O18 |
| Exact Mass | 750.237114 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KaM4k4JqhKf |
|---|---|
| Name | IRIDOLINARIN-A-PENTAACETATE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H42O18 |
| InChI | InChI=1S/C35H42O18/c1-13-22(46-15(3)37)10-20-21(11-45-32(42)24(13)20)31(41)51-26-19-8-9-43-33(25(19)35(7)30(26)53-35)52-34-29(49-18(6)40)28(48-17(5)39)27(47-16(4)38)23(50-34)12-44-14(2)36/h8-9,19-23,25-30,33-34H,10-12H2,1-7H3/t19-,20?,21?,22?,23+,25-,26+,27+,28-,29+,30+,33+,34-,35-/m1/s1 |
| InChIKey | TUBDCFRIILXFON-BPOMVFCOSA-N |
| Literature Reference Author | H.OTSUKA |
| Literature Reference Citation | J.NAT.PROD.,57,357(1994) |
| Literature Reference DOI | 10.1021/np50105a004 |
| Molecular Weight | 750.708 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWTS1890 |