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CHEBI:204697 - 12b-acetoxy-3b-hydroxy-7,11,15,23-tetraoxo-lanost-8,20E-diene-26-oic acid
| Formula | C32H42O9 |
| Net Charge | 0 |
| Average Mass | 570.679 |
| Monoisotopic Mass | 570.28288 |
| SMILES | CC(=O)O[C@@H]1C(=O)C2=C(C(=O)C[C@H]3C(C)(C)[C@@H](O)CC[C@]23C)[C@]2(C)C(=O)C[C@H](/C(C)=C/C(=O)CC(C)C(=O)O)[C@@]12C |
| InChI | InChI=1S/C32H42O9/c1-15(11-18(34)12-16(2)28(39)40)19-13-23(37)32(8)24-20(35)14-21-29(4,5)22(36)9-10-30(21,6)25(24)26(38)27(31(19,32)7)41-17(3)33/h11,16,19,21-22,27,36H,9-10,12-14H2,1-8H3,(H,39,40)/b15-11+/t16?,19-,21+,22+,27-,30+,31+,32+/m1/s1 |
| InChIKey | NPQPGDYTXMOILM-BOAPTOANSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Ganoderma lucidum (ncbitaxon:5315) | - | PubMed (18696320) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 12b-acetoxy-3b-hydroxy-7,11,15,23-tetraoxo-lanost-8,20E-diene-26-oic acid (CHEBI:204697) is a triterpenoid (CHEBI:36615) |
| IUPAC Name |
|---|
| (E)-6-[(3S,5R,10S,12S,13R,14R,17R)-12-acetyloxy-3-hydroxy-4,4,10,13,14-pentamethyl-7,11,15-trioxo-1,2,3,5,6,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxohept-5-enoic acid |
| Manual Xrefs | Databases |
|---|---|
| 78441011 | ChemSpider |