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CHEBI:213846 - 4-[2-O-11Z-octadecenoyl-beta-glucopyranosyl]-4,4′-diapolycopene-4,4′-dioic acid
| Formula | C54H78O10 |
| Net Charge | 0 |
| Average Mass | 887.208 |
| Monoisotopic Mass | 886.55950 |
| SMILES | CCCCCCC=CCCCCCCCCCC(=O)OC1C(OC(=O)C(C)=CC=CC(C)=CC=CC(C)=CC=CC=C(C)C=CC=C(C)C=CC=C(C)C(=O)O)OC(CO)C(O)C1O |
| InChI | InChI=1S/C54H78O10/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-39-48(56)63-51-50(58)49(57)47(40-55)62-54(51)64-53(61)46(7)38-28-36-44(5)34-26-32-42(3)30-24-23-29-41(2)31-25-33-43(4)35-27-37-45(6)52(59)60/h13-14,23-38,47,49-51,54-55,57-58H,8-12,15-22,39-40H2,1-7H3,(H,59,60) |
| InChIKey | KRYMBYCPXVGWGP-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Methylobacteriumspecies (ncbitaxon:409) | - | DOI (10.1016/j.tetlet.2015.04.042) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-[2-O-11Z-octadecenoyl-beta-glucopyranosyl]-4,4′-diapolycopene-4,4′-dioic acid (CHEBI:213846) is a triterpenoid (CHEBI:36615) |
| IUPAC Name |
|---|
| 24-[4,5-dihydroxy-6-(hydroxymethyl)-3-octadec-11-enoyloxyoxan-2-yl]oxy-2,6,10,15,19,23-hexamethyl-24-oxotetracosa-2,4,6,8,10,12,14,16,18,20,22-undecaenoic acid |