| SpectraBase Compound ID | J2uYlC3waMT |
|---|---|
| InChI | InChI=1S/C42H64O14/c1-20-35(44)28(45-6)14-33(50-20)55-37-22(3)52-34(16-30(37)47-8)56-36-21(2)51-32(15-29(36)46-7)53-27-13-23-9-10-24-25(40(23,4)17-26(27)43)11-12-42-19-49-41(5)38(42)31(18-48-41)54-39(24)42/h9,20-22,25-38,43-44H,10-19H2,1-8H3/t20-,21+,22-,25+,26-,27-,28+,29-,30+,31-,32-,33-,34+,35-,36+,37-,38-,40+,41-,42+/m1/s1 |
| InChIKey | NKWMTNHQVBSJCW-PHWGMENQSA-N |
| Mol Weight | 793.0 g/mol |
| Molecular Formula | C42H64O14 |
| Exact Mass | 792.429607 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LrrwWuN2kvo |
|---|---|
| Name | SUBLANCEOSIDE-G4 |
| Compound Number | 20 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H64O14 |
| InChI | InChI=1S/C42H64O14/c1-20-35(44)28(45-6)14-33(50-20)55-37-22(3)52-34(16-30(37)47-8)56-36-21(2)51-32(15-29(36)46-7)53-27-13-23-9-10-24-25(40(23,4)17-26(27)43)11-12-42-19-49-41(5)38(42)31(18-48-41)54-39(24)42/h9,20-22,25-38,43-44H,10-19H2,1-8H3/t20-,21+,22-,25+,26-,27-,28+,29-,30+,31-,32-,33-,34+,35-,36+,37-,38-,40+,41-,42+/m1/s1 |
| InChIKey | NKWMTNHQVBSJCW-PHWGMENQSA-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 | 792.962 g/mol |
| Sample ID | 55384 |
| Solvent | C5D5N |