EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C43H72O2 |
| Net Charge | 0 |
| Average Mass | 621.047 |
| Monoisotopic Mass | 620.55323 |
| SMILES | [H][C@@]12CC=C3C[C@@H](OC(=O)CCCCCCC/C=C/C/C=C/CCC)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)C([C@H](C)CCCC(C)C)CC[C@@]21[H] |
| InChI | InChI=1S/C43H72O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-23-41(44)45-36-28-30-42(5)35(32-36)24-25-37-39-27-26-38(34(4)22-20-21-33(2)3)43(39,6)31-29-40(37)42/h9-10,12-13,24,33-34,36-40H,7-8,11,14-23,25-32H2,1-6H3/b10-9+,13-12+/t34-,36+,37+,38?,39+,40+,42+,43-/m1/s1 |
| InChIKey | OYOAMRKUJRRRSM-FYALRKDYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | blood (UBERON:0000178) | PubMed (20671299) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| CE(16:2) (CHEBI:89566) is a cholesteryl ester (CHEBI:17002) |
| Synonym | Source |
|---|---|
| (1S,2R,5S,10S,11S,15R)-2,15-dimethyl-14-[(2R)-6-methylheptan-2-yl]tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-7-en-5-yl (9E,12E)-hexadeca-9,12-dienoate | HMDB |
| Manual Xrefs | Databases |
|---|---|
| HMDB0060058 | HMDB |
| Citations |
|---|