Terminology Service for NFDI4Health
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betaenone C

Go to external page http://purl.obolibrary.org/obo/CHEBI_145053

Term info

Label

betaenone C

Synonyms
  • betaenone C
database cross reference
Subsets

2_STAR

charge

0

formula

C21H34O5

has obo namespace

chebi_ontology

id

CHEBI:145053

inchi

InChI=1S/C21H34O5/c1-7-12(2)17-20(5,15(23)8-9-22)16-13(3)10-19(4,25)11-14(16)18(24)21(17,6)26/h8-9,12-14,16-17,22,25-26H,7,10-11H2,1-6H3/b9-8-/t12-,13-,14+,16+,17-,19-,20-,21+/m1/s1

inchikey

YRYPVWAJOMXOHH-ITBWMFDCSA-N

mass

366.498

monoisotopicmass

366.24062

smiles

[C@]1([C@H]([C@](C([C@@]2([C@@]1([C@@H](C[C@](C2)(O)C)C)[H])[H])=O)(C)O)[C@@H](CC)C)(C(=O)/C=C\O)C

Term relations