EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C35H36N4O6 |
| Net Charge | 0 |
| Average Mass | 608.695 |
| Monoisotopic Mass | 608.26348 |
| SMILES | C=Cc1c(C)c2cc3nc(cc4nc(cc5nc(cc1n2)C(C)=C5CCC(=O)O)c(C)c4CCC(=O)O)C(CCC(=O)O)=C3C |
| InChI | InChI=1S/C35H36N4O6/c1-6-21-17(2)25-13-26-18(3)23(8-11-34(42)43)31(37-26)16-32-24(9-12-35(44)45)20(5)28(39-32)15-30-22(7-10-33(40)41)19(4)27(38-30)14-29(21)36-25/h6,13-16,36,39H,1,7-12H2,2-5H3,(H,40,41)(H,42,43)(H,44,45)/b25-13-,26-13-,27-14-,28-15-,29-14-,30-15-,31-16-,32-16- |
| InChIKey | KECOXFKVIHSIBO-UJJXFSCMSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Malus domestica (ncbitaxon:3750) | exocarp (BTO:0000733) | MetaboLights (MTBLS2384) | Strain: Malus x domestica Borkh. cv. Ruixue |
| Sus scrofa (ncbitaxon:9823) | sausage (ENVO:00002166) | MetaboLights (MTBLS2871) |
| Roles Classification |
|---|
| Biological Role: | cofactor An organic molecule or ion (usually a metal ion) that is required by an enzyme for its activity. It may be attached either loosely (coenzyme) or tightly (prosthetic group). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Harderoporphyrin (CHEBI:169840) is a porphyrins (CHEBI:26214) |
| IUPAC Name |
|---|
| 3-[7,18-bis(2-carboxyethyl)-12-ethenyl-3,8,13,17-tetramethyl-21,23-dihydroporphyrin-2-yl]propanoic acid |