| SpectraBase Compound ID | Gompj9z90MA |
|---|---|
| InChI | InChI=1S/C40H60O14/c1-19-25(11-13-48-19)40(45)12-10-26-24(38(40)44)9-8-23-14-29(28(42)18-39(23,26)5)52-33-17-31(47-7)37(22(4)51-33)54-32-15-27(41)36(21(3)50-32)53-34-16-30(46-6)35(43)20(2)49-34/h8,11,13,20-22,24,26-37,41-43,45H,9-10,12,14-18H2,1-7H3/t20-,21+,22+,24-,26+,27-,28-,29-,30+,31-,32-,33-,34-,35-,36+,37+,39+,40-/m1/s1 |
| InChIKey | OCEXOAWTZQOMCE-HPAVBGGWSA-N |
| Mol Weight | 764.9 g/mol |
| Molecular Formula | C40H60O14 |
| Exact Mass | 764.398307 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IKgdH90dcHD |
|---|---|
| Name | SUBLANCEOSIDE-E3 |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H60O14 |
| InChI | InChI=1S/C40H60O14/c1-19-25(11-13-48-19)40(45)12-10-26-24(38(40)44)9-8-23-14-29(28(42)18-39(23,26)5)52-33-17-31(47-7)37(22(4)51-33)54-32-15-27(41)36(21(3)50-32)53-34-16-30(46-6)35(43)20(2)49-34/h8,11,13,20-22,24,26-37,41-43,45H,9-10,12,14-18H2,1-7H3/t20-,21+,22+,24-,26+,27-,28-,29-,30+,31-,32-,33-,34-,35-,36+,37+,39+,40-/m1/s1 |
| InChIKey | OCEXOAWTZQOMCE-HPAVBGGWSA-N |
| Literature Reference Author | T.WARASHINA,T.NORO |
| Literature Reference Citation | CHEM.PHARM.BULL.,54,1551(2006) |
| Literature Reference DOI | 10.1248/cpb.54.1551 |
| Molecular Weight | 764.908 g/mol |
| Sample ID | 55376 |
| Solvent | C5D5N |