| SpectraBase Compound ID | DvUWmTr6gf6 |
|---|---|
| InChI | InChI=1S/C25H30O12/c1-11-9-24(30)22-23(5,36-22)10-15-7-17(21(29)35-15)18(33-13(3)26)8-16(12(2)20(28)32-6)19(34-14(4)27)25(11,31)37-24/h7,9,15-16,18-19,22,30-31H,2,8,10H2,1,3-6H3/t15-,16+,18-,19+,22+,23-,24-,25+/m1/s1 |
| InChIKey | XXCSCQVYTNDURK-RHMOXOMNSA-N |
| Mol Weight | 522.5 g/mol |
| Molecular Formula | C25H30O12 |
| Exact Mass | 522.173726 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IPuXS63wshS |
|---|---|
| Name | BIPINNATIN_M |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H30O12 |
| InChI | InChI=1S/C25H30O12/c1-11-9-24(30)22-23(5,36-22)10-15-7-17(21(29)35-15)18(33-13(3)26)8-16(12(2)20(28)32-6)19(34-14(4)27)25(11,31)37-24/h7,9,15-16,18-19,22,30-31H,2,8,10H2,1,3-6H3/t15-,16+,18-,19+,22+,23-,24-,25+/m1/s1 |
| InChIKey | XXCSCQVYTNDURK-RHMOXOMNSA-N |
| Literature Reference Author | J.MARRERO,J.BENITEZ,A.D.RODRIGUEZ,H.ZHAO,R.G.RAPTIS |
| Literature Reference Citation | J.NAT.PROD.,71,381(2008) |
| Literature Reference DOI | 10.1021/np0705561 |
| Molecular Weight | 522.506 g/mol |
| Sample ID | 27532 |
| Solvent | CDCl3 |