input word = C00023037

Metabolite InformationStructural formula
Name 19'-Hydroxyfucoxanthinol
(3S,3'S,5R,5'R,6S,6'R)-6',7'-Didehydro-5,6-epoxy-5',6,6',7-tetrahydro-3,3',5',19'-tetrahydroxy-beta,beta-caroten-8(5H)-one
Formula C40H56O6
Mw 632.40768952
CAS RN 179948-56-2
C_ID C00023037 ,
InChIKey FFSKZYCAMGRBHN-GWVZHDCKNA-N
InChICode InChI=1S/C40H56O6/c1-28(16-12-18-30(3)34(44)26-40-37(6,7)23-33(43)25-39(40,9)46-40)14-10-11-15-29(2)17-13-19-31(27-41)20-21-35-36(4,5)22-32(42)24-38(35,8)45/h10-20,32-33,41-43,45H,22-27H2,1-9H3/b11-10+,16-12+,17-13+,28-14+,29-15+,30-18+,31-19-/t21?,32-,33-,38+,39+,40-/m0/s1
SMILES [C@]12(CC(=O)/C(=C/C=C/C(=C/C=C/C=C(/C=C\C=C(\C=C=C3C(C[C@@H](C[C@@]3(C)O)O)(C)C)/CO)\C)/C)/C)C(C[C@@H](C[C@@]1(C)O2)O)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
ChromalveolataNoelaerhabdaceaeEmiliania huxleyi Ref.
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OrganismEmiliania huxleyi
ReferenceHertzberg,Acta Chem. Scand.,B,(1988),495