| SpectraBase Compound ID | CKCfWJ3sLLn |
|---|---|
| InChI | InChI=1S/C28H40O8/c1-8-10-24(32)35-20-14-21-25(33-18(5)29)36-26(34-19(6)30)28(21)22(15-20)27(7,12-11-16(3)9-2)17(4)13-23(28)31/h9,14,17,20,22-23,25-26,31H,2-3,8,10-13,15H2,1,4-7H3/t17-,20+,22+,23+,25+,26-,27-,28-/m1/s1 |
| InChIKey | OYLJTRVIXSOCPW-MGZSJDQHSA-N |
| Mol Weight | 504.6 g/mol |
| Molecular Formula | C28H40O8 |
| Exact Mass | 504.272318 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LKc962BnER8 |
|---|---|
| Name | CASEANIGRESCEN_D |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H40O8 |
| InChI | InChI=1S/C28H40O8/c1-8-10-24(32)35-20-14-21-25(33-18(5)29)36-26(34-19(6)30)28(21)22(15-20)27(7,12-11-16(3)9-2)17(4)13-23(28)31/h9,14,17,20,22-23,25-26,31H,2-3,8,10-13,15H2,1,4-7H3/t17-,20+,22+,23+,25+,26-,27-,28-/m1/s1 |
| InChIKey | OYLJTRVIXSOCPW-MGZSJDQHSA-N |
| Literature Reference Author | R.B.WILLIAMS,A.NORRIS,J.S.MILLER,C.BIRKINSHAW,F.RATOVOSON,R. ANDRIANTSIFERANA,V.E |
| Literature Reference Citation | J.NAT.PROD.,70,206(2007) |
| Literature Reference DOI | 10.1021/np0605034 |
| Molecular Weight | 504.621 g/mol |
| Sample ID | 29617 |
| Solvent | C6D6 |