input word = C00000929

Metabolite InformationStructural formula
Name Phenicoxanthin
all-trans-Adonirubin
Formula C40H52O3
Mw 580.39164553
CAS RN 4418-72-8
C_ID C00000929 ,
InChIKey OOUTWVMJGMVRQF-ROKXECAJNA-N
InChICode InChI=1S/C40H52O3/c1-28(17-13-19-30(3)21-23-34-32(5)36(41)25-26-39(34,7)8)15-11-12-16-29(2)18-14-20-31(4)22-24-35-33(6)38(43)37(42)27-40(35,9)10/h11-24,37,42H,25-27H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,28-15+,29-16+,30-19+,31-20+/t37-/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)CCC1(C)C)/C)/C)\C)\C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaAlcaligenaceaeAlcaligenes PC1 Ref.
BacteriaRhizobiaceaeAgrobacterium aurantiacum Ref.
BacteriaRhizobiaceaeRhizobium lupini Ref.
FungiCystofilobasidiaceaePhaffia rhodozyma Ref.
PlantaeCruciferaeArabidopsis thaliana Ref.
PlantaeRanunculaceaeAdonis annua Ref.
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