| SpectraBase Compound ID | FP40btUHgZC |
|---|---|
| InChI | InChI=1S/C30H48O4/c1-25(2)21-9-12-29(6)22(27(21,4)11-10-23(25)32)8-7-19-20-17-26(3,18-31)13-15-30(20,24(33)34)16-14-28(19,29)5/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20?,21?,22?,23-,26-,27-,28+,29+,30-/m0/s1 |
| InChIKey | CZWBKSDPBWNHGO-NJMHOMCLSA-N |
| Mol Weight | 472.7 g/mol |
| Molecular Formula | C30H48O4 |
| Exact Mass | 472.35526 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BK9MadfbJYR |
|---|---|
| Name | QUERETAROIC-ACID |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H48O4 |
| InChI | InChI=1S/C30H48O4/c1-25(2)21-9-12-29(6)22(27(21,4)11-10-23(25)32)8-7-19-20-17-26(3,18-31)13-15-30(20,24(33)34)16-14-28(19,29)5/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20?,21?,22?,23-,26-,27-,28+,29+,30-/m0/s1 |
| InChIKey | CZWBKSDPBWNHGO-NJMHOMCLSA-N |
| Literature Reference Author | Y.YE,K.KINOSHITA,K.KOYAMA,K.TAKAHASHI,N.KONDO,H.YUASA |
| Literature Reference Citation | J.NAT.PROD.,61,456(1998) |
| Literature Reference DOI | 10.1021/np970364d |
| Molecular Weight | 472.709 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWCP7016 |