| SpectraBase Compound ID | vuCLUxHhuC |
|---|---|
| InChI | InChI=1S/C42H50O16/c1-49-29-11-21(7-9-27(29)45)37(47)35(17-43)57-41-31(51-3)13-23(14-32(41)52-4)39-25-19-56-40(26(25)20-55-39)24-15-33(53-5)42(34(16-24)54-6)58-36(18-44)38(48)22-8-10-28(46)30(12-22)50-2/h7-16,25-26,35-40,43-48H,17-20H2,1-6H3/t25-,26-,35?,36?,37?,38?,39+,40+/m0/s1 |
| InChIKey | LSWNERGQFCAXLI-CGLHJQFRSA-N |
| Mol Weight | 810.8 g/mol |
| Molecular Formula | C42H50O16 |
| Exact Mass | 810.309886 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GvTURtZquLR |
|---|---|
| Name | HEDYOTISOL_A |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H50O16 |
| InChI | InChI=1S/C42H50O16/c1-49-29-11-21(7-9-27(29)45)37(47)35(17-43)57-41-31(51-3)13-23(14-32(41)52-4)39-25-19-56-40(26(25)20-55-39)24-15-33(53-5)42(34(16-24)54-6)58-36(18-44)38(48)22-8-10-28(46)30(12-22)50-2/h7-16,25-26,35-40,43-48H,17-20H2,1-6H3/t25-,26-,35?,36?,37?,38?,39+,40+/m0/s1 |
| InChIKey | LSWNERGQFCAXLI-CGLHJQFRSA-N |
| Literature Reference Author | X.W.YANG,P.J.ZHAO,Y.L.MA,H.T.XIAO,Y.Q.ZUO,H.P.HE,L.LI,X.J.HA O |
| Literature Reference Citation | J.NAT.PROD.,70,521(2007) |
| Literature Reference DOI | 10.1021/np0603931 |
| Molecular Weight | 810.849 g/mol |
| Sample ID | 30075 |
| Solvent | CD3OD |