EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C41H74O7 |
| Net Charge | 0 |
| Average Mass | 679.036 |
| Monoisotopic Mass | 678.54345 |
| SMILES | CCC[C@@H](C)C[C@H](C)C[C@H](C)C(=O)CC(=O)[C@H](C)C[C@H](C)CC=C[C@@H](C)[C@@H](O)[C@@H](C)[C@@H](O)C[C@@H]1CC[C@@](C)(C2CC[C@@](C)([C@@H](C)O)O2)O1 |
| InChI | InChI=1S/C41H74O7/c1-12-14-26(2)21-28(4)23-31(7)36(44)25-35(43)30(6)22-27(3)15-13-16-29(5)39(46)32(8)37(45)24-34-17-19-41(11,47-34)38-18-20-40(10,48-38)33(9)42/h13,16,26-34,37-39,42,45-46H,12,14-15,17-25H2,1-11H3/t26-,27-,28+,29-,30-,31+,32+,33-,34+,37+,38?,39-,40+,41+/m1/s1 |
| InChIKey | DICYOBFZDAWHJC-DVGTUTCUSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-5186 (CHEBI:94460) is a diterpene glycoside (CHEBI:71939) |
| Manual Xrefs | Databases |
|---|---|
| LSM-5186 | LINCS |