| SpectraBase Compound ID | IlRajDYOKIX |
|---|---|
| InChI | InChI=1S/C31H48O8/c1-26(2,39-37)12-7-8-18(24(34)35)19-11-13-28(4)20-9-10-21-29(5,25(36)38-6)22(32)16-23(33)31(21)17-30(20,31)15-14-27(19,28)3/h7,12,18-23,32-33,37H,8-11,13-17H2,1-6H3,(H,34,35)/b12-7+/t18-,19+,20-,21-,22-,23-,27+,28-,29-,30-,31+/m0/s1 |
| InChIKey | MDZACYBINFCJBT-FGVJAIBCSA-N |
| Mol Weight | 548.7 g/mol |
| Molecular Formula | C31H48O8 |
| Exact Mass | 548.334918 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ic0W5QLOEKI |
|---|---|
| Name | QUADRANGULARIC-ACID-F |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H48O8 |
| InChI | InChI=1S/C31H48O8/c1-26(2,39-37)12-7-8-18(24(34)35)19-11-13-28(4)20-9-10-21-29(5,25(36)38-6)22(32)16-23(33)31(21)17-30(20,31)15-14-27(19,28)3/h7,12,18-23,32-33,37H,8-11,13-17H2,1-6H3,(H,34,35)/b12-7+/t18-,19+,20-,21-,22-,23-,27+,28-,29-,30-,31+/m0/s1 |
| InChIKey | MDZACYBINFCJBT-FGVJAIBCSA-N |
| Literature Reference Author | A.H.BANSKOTA,Y.TEZUKA,K.Q.TRAN,K.TANAKA,I.SAIKI,S.KADOTA |
| Literature Reference Citation | J.NAT.PROD.,63,57(2000) |
| Literature Reference DOI | 10.1021/np990336q |
| Molecular Weight | 548.717 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWRU1677 |