input word = C00023038

Metabolite InformationStructural formula
Name 19-Hexanoyloxyfucoxanthinol
(3S,3'S,5R,5'R,6S,6'R)-6',7'-Didehydro-5,6-epoxy-5',6,6',7-tetrahydro-3,3',5'-trihydroxy-19'-[(1-oxohexyl)oxy]-beta,beta-carotene
Formula C46H66O7
Mw 730.48085446
CAS RN 63929-20-4
C_ID C00023038 ,
InChIKey SRNKKOVWBXYHTK-CZFGHPFCNA-N
InChICode InChI=1S/C46H66O7/c1-11-12-13-24-41(50)52-32-36(25-26-40-42(5,6)27-37(47)29-44(40,9)51)23-17-21-34(3)19-15-14-18-33(2)20-16-22-35(4)39(49)31-46-43(7,8)28-38(48)30-45(46,10)53-46/h14-23,25,37-38,47-48,51H,11-13,24,27-32H2,1-10H3/b15-14+,20-16+,21-17+,33-18+,34-19+,35-22+,36-23-/t26-,37-,38-,44+,45+,46-/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)/COC(=O)CCCCC)\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
--Pelagococcus subviridis Ref.
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OrganismPelagococcus subviridis
ReferenceBjornland,Phytochem.,28,(1989),3347