| SpectraBase Compound ID | I8SnLoeJ3RD |
|---|---|
| InChI | InChI=1S/C30H44O6/c1-17-9-14-30(24(34)35)16-15-26(3)18(22(30)29(17,6)36)7-8-19-25(2)12-11-21(31)28(5,23(32)33)20(25)10-13-27(19,26)4/h7,19-22,31,36H,1,8-16H2,2-6H3,(H,32,33)(H,34,35)/t19-,20-,21-,22-,25-,26-,27-,28-,29-,30+/m1/s1 |
| InChIKey | YKWCPLVNXDFCGG-WCAYKKAGSA-N |
| Mol Weight | 500.7 g/mol |
| Molecular Formula | C30H44O6 |
| Exact Mass | 500.313789 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FapdLbvd2u8 |
|---|---|
| Name | DIOSPYRIC_ACID_A;3-ALPHA,19-ALPHA-DIHYDROXY-URS-12,20-(30)-DIEN-24,28-DIOIC_ACID |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H44O6 |
| InChI | InChI=1S/C30H44O6/c1-17-9-14-30(24(34)35)16-15-26(3)18(22(30)29(17,6)36)7-8-19-25(2)12-11-21(31)28(5,23(32)33)20(25)10-13-27(19,26)4/h7,19-22,31,36H,1,8-16H2,2-6H3,(H,32,33)(H,34,35)/t19-,20-,21-,22-,25-,26-,27-,28-,29-,30+/m1/s1 |
| InChIKey | YKWCPLVNXDFCGG-WCAYKKAGSA-N |
| Literature Reference Author | P.T.THUONG,C.H.LEE,T.T.DAO,P.H.NGUYEN,W.G.KIM,S.J.LEE,W.K.OH |
| Literature Reference Citation | J.NAT.PROD.,71,1775(2008) |
| Literature Reference DOI | 10.1021/np800298w |
| Molecular Weight | 500.676 g/mol |
| Sample ID | 29205 |
| Solvent | C5D5N |