EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C48H63N5O9 |
| Net Charge | 0 |
| Average Mass | 854.058 |
| Monoisotopic Mass | 853.46258 |
| SMILES | [H][C@@]12CN(CCc3c(nc4ccccc34)[C@@](C(=O)OC)(c3cc4c(cc3OC)N(C)[C@@]3([H])[C@@](O)(C(=O)OC)[C@]([H])(OC(=O)CN(C)C)[C@]5(CC)C=CCN6CC[C@]43[C@@]65[H])C1)C[C@](O)(CC)C2 |
| InChI | InChI=1S/C48H63N5O9/c1-9-44(57)24-29-25-47(42(55)60-7,38-31(16-20-52(26-29)28-44)30-14-11-12-15-34(30)49-38)33-22-32-35(23-36(33)59-6)51(5)40-46(32)18-21-53-19-13-17-45(10-2,39(46)53)41(48(40,58)43(56)61-8)62-37(54)27-50(3)4/h11-15,17,22-23,29,39-41,49,57-58H,9-10,16,18-21,24-28H2,1-8H3/t29-,39-,40+,41+,44-,45+,46+,47-,48-/m0/s1 |
| InChIKey | YNSIUGHLISOIRQ-XGNYHKEJSA-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) |
| vinglycinate (CHEBI:756542) is a vinca alkaloid (CHEBI:27288) |
| INNs | Source |
|---|---|
| vinglicinato | WHO MedNet |
| vinglycinate | WHO MedNet |