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CHEBI:35512 - ergostane

ChEBI IDCHEBI:35512
ChEBI Nameergostane
Stars
Last Modified17 January 2019
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC28H50
Net Charge0
Average Mass386.708
Monoisotopic Mass386.39125
SMILES[H][C@@]12CCC3CCCC[C@]3(C)[C@@]1([H])CC[C@@]1(C)[C@@]2([H])CC[C@]1([H])[C@H](C)CC[C@H](C)C(C)C
InChIInChI=1S/C28H50/c1-19(2)20(3)10-11-21(4)24-14-15-25-23-13-12-22-9-7-8-17-27(22,5)26(23)16-18-28(24,25)6/h19-26H,7-18H2,1-6H3/t20-,21+,22?,23-,24+,25-,26-,27-,28+/m0/s1
InChIKeyWAAWMJYYKITCGF-ADGVWNIHSA-N
ChEBI Ontology
Outgoing Relation(s)
ergostane (CHEBI:35512) is a steroid fundamental parent (CHEBI:35508)
Incoming Relation(s)
4α-formyl-ergosta-7,24(28)-dien-3β-ol (CHEBI:142849) has parent hydride ergostane (CHEBI:35512)
ergostanoid (CHEBI:50403) has parent hydride ergostane (CHEBI:35512)
5α-ergostane (CHEBI:20652) is a ergostane (CHEBI:35512)
5β-ergostane (CHEBI:20669) is a ergostane (CHEBI:35512)
IUPAC Name 
ergostane
Manual XrefsDatabases
LMST01030000LIPID MAPS
LMST01040001LIPID MAPS