input word = C00000918

Metabolite InformationStructural formula
Name Astaxanthin
(3S,3'S)-3,3'-Dihydroxy-beta,beta-carotene-4,4'-dione
Formula C40H52O4
Mw 596.38656015
CAS RN 472-61-7
C_ID C00000918 ,
InChIKey MQZIGYBFDRPAKN-IDLFNPRFNA-N
InChICode InChI=1S/C40H52O4/c1-27(17-13-19-29(3)21-23-33-31(5)37(43)35(41)25-39(33,7)8)15-11-12-16-28(2)18-14-20-30(4)22-24-34-32(6)38(44)36(42)26-40(34,9)10/h11-24,35-36,41-42H,25-26H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,27-15+,28-16+,29-19+,30-20+/t35-,36-/m0/s1
SMILES C1(=C(C(=O)[C@H](CC1(C)C)O)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C1=C(C)C(=O)[C@H](CC1(C)C)O)\C)\C)/C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaAmblycipitidaeLiobagrus reinii Ref.
AnimaliaBagridaePelteobagrus nudiceps Ref.
BacteriaAlcaligenaceaeAlcaligenes PC1 Ref.
BacteriaRhizobiaceaeAgrobacterium aurantiacum Ref.
PlantaeAmaranthaceaePfaffia rhodozyma Ref.
PlantaeRanunculaceaeAdonis aestivalis Ref.
PlantaeRanunculaceaeAdonis vernalis Ref.
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