| SpectraBase Compound ID | 2LxcT55rVjD |
|---|---|
| InChI | InChI=1S/C40H60O4/c1-22(2)39(43)28(41)21-27-36(9)18-11-16-35(7,8)26(36)15-20-38(27)31-29-24(30(32(38)39)40(44,23(3)4)33(31)42)13-14-25-34(5,6)17-12-19-37(25,29)10/h21-23,25-26,30-32,43-44H,11-20H2,1-10H3/t25-,26-,30-,31+,32?,36-,37-,38+,39+,40-/m0/s1 |
| InChIKey | XIBQGXZPEAWMMS-ZQGONOLOSA-N |
| Mol Weight | 604.9 g/mol |
| Molecular Formula | C40H60O4 |
| Exact Mass | 604.44916 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9YOma64QysW |
|---|---|
| Name | XIBQGXZPEAWMMS-ZQGONOLOSA-N |
| Compound Number | 14 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H60O4 |
| InChI | InChI=1S/C40H60O4/c1-22(2)39(43)28(41)21-27-36(9)18-11-16-35(7,8)26(36)15-20-38(27)31-29-24(30(32(38)39)40(44,23(3)4)33(31)42)13-14-25-34(5,6)17-12-19-37(25,29)10/h21-23,25-26,30-32,43-44H,11-20H2,1-10H3/t25-,26-,30-,31+,32?,36-,37-,38+,39+,40-/m0/s1 |
| InChIKey | XIBQGXZPEAWMMS-ZQGONOLOSA-N |
| Literature Reference Author | C.CLARKSON,D.STAERK,S.H.HANSEN,P.J.SMITH,J.W.JAROSZEWSKI |
| Literature Reference Citation | J.NAT.PROD.,69,1280(2006) |
| Literature Reference DOI | 10.1021/np0601612 |
| Molecular Weight | 604.914 g/mol |
| Solvent | CD3CN |
| Source File Reference | UWMZ15458 |