CHEBI:132463 - 2β-methyltetrahymanol

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ChEBI Name 2β-methyltetrahymanol
ChEBI ID CHEBI:132463
ChEBI ASCII Name 2beta-methyltetrahymanol
Definition A pentacyclic triterpenoid that consists of tetrahymanol carrying an additional methyl substituent at the 2β-position.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Gemma Holliday
Supplier Information
Download Molfile XML SDF
Formula C31H54O
Net Charge 0
Average Mass 442.761
Monoisotopic Mass 442.41747
InChI InChI=1S/C31H54O/c1-20-18-26(2,3)21-12-16-31(9)24(29(21,7)19-20)11-10-23-28(6)15-14-25(32)27(4,5)22(28)13-17-30(23,31)8/h20-25,32H,10-19H2,1-9H3/t20-,21+,22+,23-,24-,25+,28+,29+,30-,31-/m1/s1
InChIKey IRUAZLSVSAWHSS-GDKFKXPASA-N
SMILES C1[C@@H](CC([C@]2([C@]1([C@@]3([C@@](CC2)([C@]4([C@](CC3)([C@@]5([C@@](CC4)(C([C@H](CC5)O)(C)C)[H])C)[H])C)C)[H])C)[H])(C)C)C
Metabolite of Species Details
Rhodopseudomonas palustris (NCBI:txid1076) See: PubMed
Roles Classification
Biological Role(s): bacterial metabolite
Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2β-methyltetrahymanol (CHEBI:132463) has functional parent tetrahymanol (CHEBI:9493)
2β-methyltetrahymanol (CHEBI:132463) has parent hydride gammacerane (CHEBI:36473)
2β-methyltetrahymanol (CHEBI:132463) has role bacterial metabolite (CHEBI:76969)
2β-methyltetrahymanol (CHEBI:132463) is a pentacyclic triterpenoid (CHEBI:25872)
2β-methyltetrahymanol (CHEBI:132463) is a secondary alcohol (CHEBI:35681)
IUPAC Name
2β-methylgammaceran-21α-ol
Synonyms Sources
(2β,21α)-2-methylgammaceran-21-ol IUPAC
2-methyltetrahymanol ChEBI
Citations Waiting for Citations Types Sources
24496464 PubMed citation Europe PMC
24888970 PubMed citation SUBMITTER
25935452 PubMed citation Europe PMC
Last Modified
08 November 2016