CHEBI:17938 - 5α-ergosta-7,22-diene-3β,5-diol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5α-ergosta-7,22-diene-3β,5-diol
ChEBI ID CHEBI:17938
ChEBI ASCII Name 5alpha-ergosta-7,22-diene-3beta,5-diol
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:12174, CHEBI:2143
Supplier Information
Download Molfile XML SDF
Formula C28H46O2
Net Charge 0
Average Mass 414.66364
Monoisotopic Mass 414.34978
InChI InChI=1S/C28H46O2/c1-18(2)19(3)7-8-20(4)23-9-10-24-22-12-16-28(30)17-21(29)11-15-27(28,6)25(22)13-14-26(23,24)5/h7-8,12,18-21,23-25,29-30H,9-11,13-17H2,1-6H3/b8-7+/t19-,20+,21-,23+,24-,25-,26+,27+,28+/m0/s1
InChIKey KKCUYJKFHVZXJO-AWKCEKCTSA-N
SMILES [H][C@@]1(CC[C@@]2([H])C3=CC[C@@]4(O)C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)\C=C\[C@H](C)C(C)C
ChEBI Ontology
Outgoing 5α-ergosta-7,22-diene-3β,5-diol (CHEBI:17938) has parent hydride 5α-ergostane (CHEBI:20652)
5α-ergosta-7,22-diene-3β,5-diol (CHEBI:17938) is a 3β-sterol (CHEBI:35348)
5α-ergosta-7,22-diene-3β,5-diol (CHEBI:17938) is a 5α-hydroxy steroid (CHEBI:38194)
IUPAC Name
5α-ergosta-7,22-diene-3β,5-diol
Synonyms Sources
5alpha-Ergosta-7,22-diene-3beta,5-diol KEGG COMPOUND
5α-ergosta-7,22-diene-3β,5-diol UniProt
Manual Xref Database
C04416 KEGG COMPOUND
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Last Modified
16 November 2017