| SpectraBase Compound ID | 3ArYFwDNu2S |
|---|---|
| InChI | InChI=1S/C30H42O9/c1-14(24(36)37)8-15(31)12-27(5,38)19-10-21(34)29(7)28(19,6)20(33)9-18-26(4)13-16(32)23(35)25(2,3)17(26)11-22-30(18,29)39-22/h9-10,14,16-17,21-23,32,34-35,38H,8,11-13H2,1-7H3,(H,36,37)/t14?,16-,17?,21-,22+,23+,26+,27-,28+,29-,30-/m1/s1 |
| InChIKey | DRCONWGQHWLZJX-DGLWBDQGSA-N |
| Mol Weight | 546.7 g/mol |
| Molecular Formula | C30H42O9 |
| Exact Mass | 546.282883 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HhCFXL5Nfpn |
|---|---|
| Name | ELFVINGIC-ACID-D;7-BETA,8-BETA-EPOXY-2-ALPHA,3-BETA,15-BETA,20S-TETRAHYDROXY-12,23-DIOXOLANOST-9(11),16-DIEN-26-OIC-ACID |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H42O9 |
| InChI | InChI=1S/C30H42O9/c1-14(24(36)37)8-15(31)12-27(5,38)19-10-21(34)29(7)28(19,6)20(33)9-18-26(4)13-16(32)23(35)25(2,3)17(26)11-22-30(18,29)39-22/h9-10,14,16-17,21-23,32,34-35,38H,8,11-13H2,1-7H3,(H,36,37)/t14?,16-,17?,21-,22+,23+,26+,27-,28+,29-,30-/m1/s1 |
| InChIKey | DRCONWGQHWLZJX-DGLWBDQGSA-N |
| Literature Reference Author | K.YOSHIKAWA,N.NISHIMURA,S.BANDO,S.ARIHARA,E.MATSUMURA,S.KATA YAMA |
| Literature Reference Citation | J.NAT.PROD.,65,548(2002) |
| Literature Reference DOI | 10.1021/np0103160 |
| Molecular Weight | 546.658 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWSI5615 |