EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C46H58N4O9 |
| Net Charge | 0 |
| Average Mass | 810.989 |
| Monoisotopic Mass | 810.42038 |
| SMILES | CCC1(O)CC2CN(CCc3c(nc4ccccc34)C(C(=O)OC)(c3cc4c(cc3OC)N(C)C3C(O)(C(=O)OC)C(C(=O)OC)C5(CC)C=CCN6CCC43C65)C2)C1 |
| InChI | InChI=1S/C46H58N4O9/c1-8-42(54)23-27-24-45(40(52)58-6,36-29(15-19-49(25-27)26-42)28-13-10-11-14-32(28)47-36)31-21-30-33(22-34(31)56-4)48(3)39-44(30)17-20-50-18-12-16-43(9-2,38(44)50)35(37(51)57-5)46(39,55)41(53)59-7/h10-14,16,21-22,27,35,38-39,47,54-55H,8-9,15,17-20,23-26H2,1-7H3 |
| InChIKey | SLIRURSWQCRWFG-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Biological Role: | metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-1395 (CHEBI:91589) is a vinca alkaloid (CHEBI:27288) |
| Manual Xrefs | Databases |
|---|---|
| LSM-1395 | LINCS |