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CHEBI:10333 - alpha-Spinasterol

ChEBI IDCHEBI:10333
ChEBI Namealpha-Spinasterol
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC29H48O
Net Charge0
Average Mass412.702
Monoisotopic Mass412.37052
SMILES[H][C@@]12CC=C3[C@]([H])(CC[C@@]4(C)[C@@]3([H])CC[C@]4([H])[C@H](C)/C=C/[C@@H](CC)C(C)C)[C@@]1(C)CC[C@H](O)C2
InChIInChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-9,11,19-23,25-27,30H,7,10,12-18H2,1-6H3/b9-8+/t20-,21-,22+,23+,25-,26+,27+,28+,29-/m1/s1
InChIKeyJZVFJDZBLUFKCA-FXIAWGAOSA-N
ChEBI Ontology
Outgoing Relation(s)
alpha-Spinasterol (CHEBI:10333) has parent hydride stigmastane (CHEBI:26773)
alpha-Spinasterol (CHEBI:10333) is a steroid (CHEBI:35341)
Synonyms  Source
alpha-SpinasterolKEGG COMPOUND
SpinasterolKEGG COMPOUND
Manual XrefsDatabases
C08840KEGG COMPOUND
C00003673KNApSAcK
Registry NumbersSources
CAS:481-18-5KEGG COMPOUND