EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C51H79NO13 |
| Net Charge | 0 |
| Average Mass | 914.187 |
| Monoisotopic Mass | 913.55514 |
| SMILES | CO[C@H]1C[C@@H]2CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N2CCCC[C@H]2C(=O)O[C@H]([C@H](C)C[C@@H]2CC[C@@H](O)[C@H](OC)C2)CC(=O)[C@H](C)C=C(C)[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)C=CC=CC=C1C |
| InChI | InChI=1S/C51H79NO13/c1-30-16-12-11-13-17-31(2)42(61-8)28-38-21-19-36(7)51(60,65-38)48(57)49(58)52-23-15-14-18-39(52)50(59)64-43(33(4)26-37-20-22-40(53)44(27-37)62-9)29-41(54)32(3)25-35(6)46(56)47(63-10)45(55)34(5)24-30/h11-13,16-17,25,30,32-34,36-40,42-44,46-47,53,56,60H,14-15,18-24,26-29H2,1-10H3/t30-,32-,33-,34-,36-,37+,38+,39+,40-,42+,43+,44-,46-,47+,51-/m1/s1 |
| InChIKey | QFJCIRLUMZQUOT-GZKNZQCBSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-4886 (CHEBI:94263) is a lactam (CHEBI:24995) |
| LSM-4886 (CHEBI:94263) is a macrolide (CHEBI:25106) |
| Manual Xrefs | Databases |
|---|---|
| LSM-4886 | LINCS |