| SpectraBase Compound ID | ErbQx7OQp8d |
|---|---|
| InChI | InChI=1S/C65H106O31/c1-25-36(70)40(74)45(79)54(87-25)94-51-31(22-68)90-53(49(83)44(51)78)86-24-32-39(73)43(77)48(82)57(91-32)96-59(84)65-17-15-60(2,3)19-27(65)26-9-10-34-62(6)13-12-35(61(4,5)33(62)11-14-64(34,8)63(26,7)16-18-65)92-58-52(95-56-47(81)42(76)38(72)30(21-67)89-56)50(28(69)23-85-58)93-55-46(80)41(75)37(71)29(20-66)88-55/h9,25,27-58,66-83H,10-24H2,1-8H3/t25-,27+,28+,29-,30+,31-,32-,33+,34-,35+,36-,37-,38+,39-,40+,41+,42-,43+,44-,45+,46-,47+,48-,49-,50+,51-,52-,53-,54-,55+,56-,57+,58+,62+,63-,64-,65+/m1/s1 |
| InChIKey | WKFFFKKWDNJSNL-NXCMTGJWSA-N |
| Mol Weight | 1383.5 g/mol |
| Molecular Formula | C65H106O31 |
| Exact Mass | 1382.671807 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4t8Rv0J98yk |
|---|---|
| Name | LEONTICIN-E |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C65H106O31 |
| InChI | InChI=1S/C65H106O31/c1-25-36(70)40(74)45(79)54(87-25)94-51-31(22-68)90-53(49(83)44(51)78)86-24-32-39(73)43(77)48(82)57(91-32)96-59(84)65-17-15-60(2,3)19-27(65)26-9-10-34-62(6)13-12-35(61(4,5)33(62)11-14-64(34,8)63(26,7)16-18-65)92-58-52(95-56-47(81)42(76)38(72)30(21-67)89-56)50(28(69)23-85-58)93-55-46(80)41(75)37(71)29(20-66)88-55/h9,25,27-58,66-83H,10-24H2,1-8H3/t25-,27+,28+,29-,30+,31-,32-,33+,34-,35+,36-,37-,38+,39-,40+,41+,42-,43+,44-,45+,46-,47+,48-,49-,50+,51-,52-,53-,54-,55+,56-,57+,58+,62+,63-,64-,65+/m1/s1 |
| InChIKey | WKFFFKKWDNJSNL-NXCMTGJWSA-N |
| Literature Reference Author | H.GAO,Z.WANG |
| Literature Reference Citation | PHYTOCHEM.,67,2697(2006) |
| Literature Reference DOI | 10.1016/j.phytochem.2006.09.003 |
| Molecular Weight | 1383.538 g/mol |
| Sample ID | 67205 |
| Solvent | C5D5N |