| SpectraBase Compound ID | 6ttuX1DvdqR |
|---|---|
| InChI | InChI=1S/C41H56O8/c1-24(42)47-27-12-10-26(11-13-27)34(44)49-32-22-33(48-25(2)43)40(9)28(37(32,5)6)14-17-38(7)29-16-19-41(35(45)46)21-20-36(3,4)23-31(41)39(29,8)18-15-30(38)40/h10-13,16,28,30-33H,14-15,17-23H2,1-9H3,(H,45,46)/t28?,30?,31?,32-,33+,38-,39+,40-,41+/m0/s1 |
| InChIKey | RGOQBPMRWLXHGJ-VVKMFNHUSA-N |
| Mol Weight | 676.9 g/mol |
| Molecular Formula | C41H56O8 |
| Exact Mass | 676.397519 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 283U8EcQJmh |
|---|---|
| Name | 1-BETA-ACETOXYALEURITOLIC-ACID-3-PARA-ACETOXYBENZOATE |
| Compound Number | 10 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H56O8 |
| InChI | InChI=1S/C41H56O8/c1-24(42)47-27-12-10-26(11-13-27)34(44)49-32-22-33(48-25(2)43)40(9)28(37(32,5)6)14-17-38(7)29-16-19-41(35(45)46)21-20-36(3,4)23-31(41)39(29,8)18-15-30(38)40/h10-13,16,28,30-33H,14-15,17-23H2,1-9H3,(H,45,46)/t28?,30?,31?,32-,33+,38-,39+,40-,41+/m0/s1 |
| InChIKey | RGOQBPMRWLXHGJ-VVKMFNHUSA-N |
| Literature Reference Author | S.K.CHAUDHURI,F.FULLAS,D.M.BROWN,M.C.WANI,M.E.WALL,L.CAI,W.M AR,S.K.LEE,Y.LUO,K.Z |
| Literature Reference Citation | J.NAT.PROD.,58,1(1995) |
| Literature Reference DOI | 10.1021/np50115a001 |
| Molecular Weight | 676.891 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVP5466 |