input word = C00022845

Metabolite InformationStructural formula
Name 3',4'-Didehydro-1',2'-dihydro-1'-hydroxy-beta,psi-carotene
Formula C40H56O
Mw 552.43311641
CAS RN 59122-37-1
C_ID C00022845 ,
InChIKey JLURGIFQNZBRAB-CJXMTMHDSA-N
InChICode InChI=1S/C40H56O/c1-32(20-13-22-34(3)23-14-24-35(4)26-16-31-40(9,10)41)18-11-12-19-33(2)21-15-25-36(5)28-29-38-37(6)27-17-30-39(38,7)8/h11-16,18-26,28-29,41H,17,27,30-31H2,1-10H3/b12-11+,20-13+,21-15+,23-14+,26-16+,29-28+,32-18+,33-19+,34-22+,35-24+,36-25+
SMILES C1CCC(=C(C1(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C=C(/C=C/CC(C)(O)C)\C)\C)\C)/C)/C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--SpirochaetaceaeSpirochaeta aurantia J1 Ref.
BacteriaMyxoccaceaeMyxococcus fulvus str. MXf2 Ref.
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