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CHEBI:181811 - (3R)-3',4'-Didehydro-beta,psi-carotene-3-ol

ChEBI IDCHEBI:181811
ChEBI Name(3R)-3',4'-Didehydro-beta,psi-carotene-3-ol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC40H54O
Net Charge0
Average Mass550.871
Monoisotopic Mass550.41747
SMILESCC(C)=C/C=C/C(C)=C/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C1=C(C)C[C@@H](O)CC1(C)C
InChIInChI=1S/C40H54O/c1-31(2)17-13-20-34(5)23-15-25-35(6)24-14-21-32(3)18-11-12-19-33(4)22-16-26-36(7)27-28-39-37(8)29-38(41)30-40(39,9)10/h11-28,38,41H,29-30H2,1-10H3/b12-11+,20-13+,21-14+,22-16+,25-15+,28-27+,32-18+,33-19+,34-23+,35-24+,36-26+/t38-/m1/s1
InChIKeyYYAZSYBBIFIQJT-COVUSDHRSA-N
ChEBI Ontology
Outgoing Relation(s)
(3R)-3',4'-Didehydro-beta,psi-carotene-3-ol (CHEBI:181811) is a xanthophyll (CHEBI:27325)
IUPAC Name 
(1R)-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E,19E,21E)-3,7,12,16,20,24-hexamethylpentacosa-1,3,5,7,9,11,13,15,17,19,21,23-dodecaenyl]-3,5,5-trimethylcyclohex-3-en-1-ol
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