OntologieschebiclassesCHEBI:9401   
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taraxasterol
http://purl.obolibrary.org/obo/CHEBI_9401

A pentacyclic triterpenoid that is taraxastane with a beta-hydroxy group at position 3.

Also appears inslm
Exact Synonyms
(3beta,18alpha,19alpha)-urs-20(30)-en-3-ol
Taraxasterol
Related Synonyms
alpha-lactucerol
isolactucerol
taraxasterin
class Information
charge

0

formula

C30H50O

has_obo_namespace

chebi_ontology

inchi

InChI=1S/C30H50O/c1-19-11-14-27(5)17-18-29(7)21(25(27)20(19)2)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h20-25,31H,1,9-18H2,2-8H3/t20-,21-,22+,23-,24+,25-,27-,28+,29-,30-/m1/s1

inchikey

XWMMEBCFHUKHEX-ZJJHUPNDSA-N

in_subset

3_STAR

mass

426.71740

monoisotopicmass

426.38617

smiles

C[C@H]1[C@@H]2[C@H]3CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@@]2(C)CCC1=C

class Relations