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CHEBI:169157 - Phaeophorbide b
| Formula | C35H34N4O6 |
| Net Charge | 0 |
| Average Mass | 606.679 |
| Monoisotopic Mass | 606.24783 |
| SMILES | C=CC1=C(C)C2=N/C1=C\C1=NC(=C(CC)/C1=C/O)/C=C1\N=C3C(=C1C)C(=O)C(C(=O)OC)/C3=C1/N/C(=C\2)C(C)C1CCC(=O)O |
| InChI | InChI=1S/C35H34N4O6/c1-7-18-15(3)22-11-23-16(4)20(9-10-28(41)42)32(38-23)30-31(35(44)45-6)34(43)29-17(5)24(39-33(29)30)12-26-19(8-2)21(14-40)27(37-26)13-25(18)36-22/h7,11-14,16,20,31,38,40H,1,8-10H2,2-6H3,(H,41,42)/b21-14-,23-11-,24-12-,25-13-,32-30- |
| InChIKey | KZTYPOGXRFTJBN-BRKSNRGZSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Malus domestica (ncbitaxon:3750) | exocarp (BTO:0000733) | MetaboLights (MTBLS2384) | Strain: Malus x domestica Borkh. cv. Ruixue |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Phaeophorbide b (CHEBI:169157) is a tetrapyrrole (CHEBI:26932) |
| IUPAC Name |
|---|
| 3-[(12Z)-16-ethenyl-11-ethyl-12-(hydroxymethylidene)-3-methoxycarbonyl-17,21,26-trimethyl-4-oxo-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5(26),6,8,10,13(25),14,16,18(24),19-decaen-22-yl]propanoic acid |