| SpectraBase Compound ID | 4pfliBToi7J |
|---|---|
| InChI | InChI=1S/C34H52O7/c1-20-11-16-34(28(37)38)18-17-31(6)23(27(34)33(20,8)39)9-10-25-29(4)14-13-26(41-22(3)36)30(5,19-40-21(2)35)24(29)12-15-32(25,31)7/h9,20,24-27,39H,10-19H2,1-8H3,(H,37,38)/t20-,24-,25-,26-,27-,29+,30-,31-,32-,33-,34+/m1/s1 |
| InChIKey | OWEFAQRLXAATCI-VPNLWJQUSA-N |
| Mol Weight | 572.8 g/mol |
| Molecular Formula | C34H52O7 |
| Exact Mass | 572.371304 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 24x2ljRYSnA |
|---|---|
| Name | BARBINERVIC-ACID-3,24-DIACETATE |
| Compound Number | 3A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H52O7 |
| InChI | InChI=1S/C34H52O7/c1-20-11-16-34(28(37)38)18-17-31(6)23(27(34)33(20,8)39)9-10-25-29(4)14-13-26(41-22(3)36)30(5,19-40-21(2)35)24(29)12-15-32(25,31)7/h9,20,24-27,39H,10-19H2,1-8H3,(H,37,38)/t20-,24-,25-,26-,27-,29+,30-,31-,32-,33-,34+/m1/s1 |
| InChIKey | OWEFAQRLXAATCI-VPNLWJQUSA-N |
| Literature Reference Author | B.N.SU,Y.H.KANG,R.E.PINOS,B.D.SANTARSIERO,A.D.MESECAR,D.D.SO EJARTO,H.H.S.FONG,J. |
| Literature Reference Citation | PHYTOCHEM.,64,293(2003) |
| Literature Reference DOI | 10.1016/S0031-9422(03)00268-1 |
| Molecular Weight | 572.783 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWKP4627 |