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CHEBI:50106 - 5β-scymnol
| Formula | C27H48O6 |
| Net Charge | 0 |
| Average Mass | 468.675 |
| Monoisotopic Mass | 468.34509 |
| SMILES | [H][C@@]12C[C@H](O)CC[C@]1(C)[C@@]1([H])C[C@H](O)[C@@]3(C)[C@@]([H])(CC[C@]3([H])[C@H](C)CC[C@@H](O)C(CO)CO)[C@]1([H])[C@H](O)C2 |
| InChI | InChI=1S/C27H48O6/c1-15(4-7-22(31)16(13-28)14-29)19-5-6-20-25-21(12-24(33)27(19,20)3)26(2)9-8-18(30)10-17(26)11-23(25)32/h15-25,28-33H,4-14H2,1-3H3/t15-,17+,18-,19-,20+,21+,22-,23-,24+,25+,26+,27-/m1/s1 |
| InChIKey | DIPHJTHZUWDJIK-JPLAUYQNSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5β-scymnol (CHEBI:50106) has parent hydride 5β-cholestane (CHEBI:35517) |
| 5β-scymnol (CHEBI:50106) is a 12α-hydroxy steroid (CHEBI:36846) |
| 5β-scymnol (CHEBI:50106) is a 24-hydroxy steroid (CHEBI:36865) |
| 5β-scymnol (CHEBI:50106) is a 26-hydroxy steroid (CHEBI:36852) |
| 5β-scymnol (CHEBI:50106) is a 27-hydroxy steroid (CHEBI:37914) |
| 5β-scymnol (CHEBI:50106) is a 3α-hydroxy steroid (CHEBI:36835) |
| 5β-scymnol (CHEBI:50106) is a 7α-hydroxy steroid (CHEBI:36843) |
| Incoming Relation(s) |
| 5β-scymnol sulfate (CHEBI:50107) has functional parent 5β-scymnol (CHEBI:50106) |
| IUPAC Name |
|---|
| (24R)-5β-cholestane-3α,7α,12α,24,26,27-hexol |
| Synonyms | Source |
|---|---|
| Scymnol | ChemIDplus |
| 5beta-Scymnol | KEGG COMPOUND |
| 5beta-Cholestane-3alpha,7alpha,12alpha,24,26,27-hexol | KEGG COMPOUND |
| UniProt Name | Source |
|---|---|
| 5β-scymnol | UniProt |