input word = C00022811

Metabolite InformationStructural formula
Name 3'4'-Didehydro-gamma,psi-carotene
Formula C40H54
Mw 534.42255172
CAS RN 63975-43-9
C_ID C00022811 ,
InChIKey IGEDLEDFNSPRTB-MXBSLTGDNA-N
InChICode InChI=1S/C40H54/c1-32(2)18-13-21-35(5)24-15-26-36(6)25-14-22-33(3)19-11-12-20-34(4)23-16-27-37(7)29-30-39-38(8)28-17-31-40(39,9)10/h11-16,18-27,29-30,39H,8,17,28,31H2,1-7,9-10H3/b12-11+,21-13+,22-14+,23-16+,26-15+,30-29+,33-19+,34-20+,35-24+,36-25+,37-27+/t39-/m0/s1
SMILES C(=C\[C@@H]1C(CCCC1=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)\C)/C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaCoccinellidaeCoccinella septempunctata Ref.
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OrganismCoccinella septempunctata
ReferenceBritton,Insect Biochem.,7,(1977),337