| SpectraBase Compound ID | FgASnYAPVuB |
|---|---|
| InChI | InChI=1S/C41H62O14/c1-20-26(12-14-49-20)41(45)13-11-27-25(39(41)44)10-9-24-15-29(28(42)19-40(24,27)5)53-33-17-31(47-7)37(22(3)51-33)55-35-18-32(48-8)38(23(4)52-35)54-34-16-30(46-6)36(43)21(2)50-34/h9,12,14,21-23,25,27-38,42-43,45H,10-11,13,15-19H2,1-8H3/t21-,22+,23-,25-,27+,28-,29-,30+,31-,32+,33-,34-,35+,36-,37+,38-,40+,41-/m1/s1 |
| InChIKey | BKMTVEKXAQFBQB-OATOQLLOSA-N |
| Mol Weight | 778.9 g/mol |
| Molecular Formula | C41H62O14 |
| Exact Mass | 778.413957 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3rx5GYf3Ylo |
|---|---|
| Name | SUBLANCEOSIDE-G3 |
| Compound Number | 19 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H62O14 |
| InChI | InChI=1S/C41H62O14/c1-20-26(12-14-49-20)41(45)13-11-27-25(39(41)44)10-9-24-15-29(28(42)19-40(24,27)5)53-33-17-31(47-7)37(22(3)51-33)55-35-18-32(48-8)38(23(4)52-35)54-34-16-30(46-6)36(43)21(2)50-34/h9,12,14,21-23,25,27-38,42-43,45H,10-11,13,15-19H2,1-8H3/t21-,22+,23-,25-,27+,28-,29-,30+,31-,32+,33-,34-,35+,36-,37+,38-,40+,41-/m1/s1 |
| InChIKey | BKMTVEKXAQFBQB-OATOQLLOSA-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 | 778.935 g/mol |
| Sample ID | 55383 |
| Solvent | C5D5N |