EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C42H72O16 |
| Net Charge | 0 |
| Average Mass | 833.022 |
| Monoisotopic Mass | 832.48204 |
| SMILES | [H][C@]1([C@@H](C)[C@H](C)O)OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@H](OC(C)=O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](OC)[C@H]2O)[C@@H](C)C[C@](C)(O)C(=O)[C@H](C)[C@@H](OC(C)=O)[C@H]1C |
| InChI | InChI=1S/C42H72O16/c1-19-17-41(12,49)37(47)24(6)35(54-28(10)44)23(5)34(21(3)26(8)43)57-39(48)25(7)36(22(4)33(19)58-40-32(46)30(50-14)16-20(2)52-40)56-31-18-42(13,51-15)38(27(9)53-31)55-29(11)45/h19-27,30-36,38,40,43,46,49H,16-18H2,1-15H3/t19-,20+,21-,22+,23-,24+,25+,26-,27-,30-,31-,32+,33-,34+,35-,36-,38+,40-,41-,42+/m0/s1 |
| InChIKey | JQMACDQCTNFQMM-QAOHEUSVSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Lankamycin (CHEBI:80017) is a macrolide (CHEBI:25106) |