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CHEBI:175728 - 27-Hydroxyisomangiferolic acid
| Formula | C30H48O4 |
| Net Charge | 0 |
| Average Mass | 472.710 |
| Monoisotopic Mass | 472.35526 |
| SMILES | CC(CC/C=C(/CO)C(=O)O)C1CCC2(C)C3CCC4C(C)(C)C(O)CCC45CC35CCC12C |
| InChI | InChI=1S/C30H48O4/c1-19(7-6-8-20(17-31)25(33)34)21-11-13-28(5)23-10-9-22-26(2,3)24(32)12-14-29(22)18-30(23,29)16-15-27(21,28)4/h8,19,21-24,31-32H,6-7,9-18H2,1-5H3,(H,33,34)/b20-8- |
| InChIKey | YWPLTMNXKKXXII-ZBKNUEDVSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 27-Hydroxyisomangiferolic acid (CHEBI:175728) is a triterpenoid (CHEBI:36615) |
| IUPAC Name |
|---|
| (Z)-2-(hydroxymethyl)-6-(6-hydroxy-7,7,12,16-tetramethyl-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl)hept-2-enoic acid |
| Manual Xrefs | Databases |
|---|---|
| 72390814 | ChemSpider |
| HMDB0036064 | HMDB |