input word = C00003780

Metabolite InformationStructural formula
Name Neoxanthin
Folioxanthin
Formula C40H56O4
Mw 600.41786028
CAS RN 14660-91-4
C_ID C00003780 ,
InChIKey PGYAYSRVSAJXTE-ALKGEJJMNA-N
InChICode InChI=1S/C40H56O4/c1-29(17-13-19-31(3)21-22-35-36(5,6)25-33(41)27-38(35,9)43)15-11-12-16-30(2)18-14-20-32(4)23-24-40-37(7,8)26-34(42)28-39(40,10)44-40/h11-21,23-24,33-34,41-43H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,24-23+,29-15+,30-16+,31-19+,32-20+/t22?,33-,34-,38+,39+,40-/m0/s1
SMILES [C@]12(/C=C/C(=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)\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
PlantaeAnacardiaceaeMangifera indica Ref.
PlantaeApiaceaeDaucus carota Ref.
PlantaeApocynaceaeCatharanthus roseus Ref.
PlantaeAsparagaceaeAsparagus officinalis Ref.
PlantaeAsteraceaeHelianthus annuus Ref.
PlantaeAsteraceaeTagetes erecta L. Ref.
PlantaeCaricaceaeCarica papaya Ref.
PlantaeCeratophyllaceaeCeratophyllum demersum Ref.
PlantaeChenopodiaceaeSpinacia oleracea Ref.
PlantaeCruciferaeArabidopsis thaliana Ref.
PlantaeCruciferaeBrassica rapa ssp. chinensis Ref.
PlantaeCucurbitaceaeCucurbita sp. Ref.
PlantaeDioscoreaceaeDioscorea bulbifera Ref.
PlantaeFabaceaeCytisus scoparius Ref.
PlantaeOleaceaeForsythia spp. Ref.
PlantaePassifloraceaePassiflora edulis Ref.
PlantaePoaceaeOryza sativa Ref.
PlantaePotamogetonaceaePotamogeton perfoliatus Ref.
PlantaeRanunculaceaeCaltha palustris Ref.
PlantaeRosaceaeGeum spp. Ref.
PlantaeRosaceaeMalus spp. Ref.
PlantaeRosaceaePrunus domestica Ref.
PlantaeRosaceaePrunus persica Ref.
PlantaeRubiaceaeCoffea arabica Ref.
PlantaeRubiaceaeCoffea canephora Ref.
PlantaeSolanaceaeCapsicum annuum Ref.
PlantaeSolanaceaeSolanum tuberosum Ref.
--Caffea sp. Ref.
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OrganismCarica papaya
Referencehttps://doi.org/10.1016/j.foodchem.2018.10.102