KNApSAcK Metabolite Information

input word = C00003776

Metabolite Information

Structural formula

Name

Lutein
(all-E)-Lutein
(3R,3'R,6'R)-beta,epsilon-Carotene-3,3'-diol
all-trans-(+)-Xanthophyll

Formula

C40H56O2

568.42803103

CAS RN

127-40-2

C_ID

C00003776 ,

InChIKey

KBPHJBAIARWVSC-MMZBKWJPNA-N

InChICode

InChI=1S/C40H56O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-25,35-37,41-42H,26-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t35-,36+,37-/m0/s1

SMILES

C1(=C(C[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=C/[C@@H]1C(C[C@H](C=C1C)O)(C)C)\C)/C)/C

Start Substs in Alk. Biosynthesis (Prediction)

Organism

Kingdom	Family	Species	Reference
--	Bangiaceae	Porphyra tenera	Ref.
--	Rhodomelaceae	Polysiphonia brodiaei	Ref.
--	Rhodomelaceae	Polysiphonia urceolata	Ref.
Animalia	Bagridae	Pelteobagrus nudiceps	Ref.
Animalia	Bagridae	Pseudobagrus aurantiacus	Ref.
Animalia	Callichthyidae	Corydoras melanistius	Ref.
Animalia	Cyprinidae	Carassius auratus	Ref.
Animalia	Ictaluridae	Ictalurus punctatus	Ref.
Animalia	Malapteruridae	Malapterurus electricus	Ref.
Animalia	Penaeidae	Penaeus orientalis	Ref.
Animalia	Siluridae	Silurus asotus	Ref.
Animalia	Siluridae	Silurus biwaensis	Ref.
Animalia	Siluridae	Silurus microdorsalis	Ref.
Plantae	Actinidiaceae	Actinidia chinensis	Ref.
Plantae	Actinidiaceae	Actinidia deliciosa	Ref.
Plantae	Actinidiaceae	Actinidia macrosperma	Ref.
Plantae	Anacardiaceae	Mangifera indica	Ref.
Plantae	Apiaceae	Daucus carota	Ref.
Plantae	Aristolochiaceae	Ceramium rubrum	Ref.
Plantae	Asparagaceae	Asparagus officinalis L.	Ref.
Plantae	Asteraceae	Dendranthema grandiflorum (Ramat.) Kitamura	Ref.
Plantae	Asteraceae	Helianthus annuus L.	Ref.
Plantae	Asteraceae	Helianthus heterophyllus	Ref.
Plantae	Asteraceae	Tagetes erecta	Ref.
Plantae	Asteraceae	Taraxacum officinale	Ref.
Plantae	Begoniaceae	Begonia nantoensis	Ref.
Plantae	Blechnaceae	Stenochlaena palustris	Ref.
Plantae	Bromeliaceae	Ananas comosus	Ref.
Plantae	Caricaceae	Carica papaya	Ref.
Plantae	Cephalotaxaceae	Amentotaxus yunnanensis	Ref.
Plantae	Colchicaceae	Colchicum luteum Baker.	Ref.
Plantae	Convolvulaceae	Cuscuta australis	Ref.
Plantae	Convolvulaceae	Cuscuta japonica	Ref.
Plantae	Corbiculidae	Corbicula japonica	Ref.
Plantae	Corbiculidae	Corbicula sandai	Ref.
Plantae	Cruciferae	Arabidopsis thaliana	Ref.
Plantae	Cruciferae	Brassica oleracea var. gongylodes	Ref.
Plantae	Cruciferae	Brassica rapa ssp. chinensis	Ref.
Plantae	Cruciferae	Brassica spp.	Ref.
Plantae	Cruciferae	Isatis tinctoria	Ref.
Plantae	Cruciferae	Raphanus sativus	Ref.
Plantae	Cucurbitaceae	Cucumis sativus L.	Ref.
Plantae	Cucurbitaceae	Momordica charantia	Ref.
Plantae	Cyprinidae	Cyprinus carpio	Ref.
Plantae	Ericaceae	Vaccinium macrocarpon	Ref.
Plantae	Fabaceae	Glycine max	Ref.
Plantae	Malvaceae	Helicteres isora	Ref.
Plantae	Moraceae	Dorstenia poinsettifolia	Ref.
Plantae	Myrtaceae	Psidium guajava	Ref.
Plantae	Pandanaceae	Pandanus tectorius	Ref.
Plantae	Poaceae	Oryza sativa	Ref.
Plantae	Poaceae	Triticum aestivum	Ref.
Plantae	Potamogetonaceae	Potamogeton perfoliatus	Ref.
Plantae	Rosaceae	Prunus spp.	Ref.
Plantae	Rosaceae	Rosa foetida	Ref.
Plantae	Rubiaceae	Coffea arabica	Ref.
Plantae	Rubiaceae	Coffea canephora	Ref.
Plantae	Rutaceae	Citrus limon	Ref.
Plantae	Rutaceae	Citrus limonia	Ref.
Plantae	Rutaceae	Citrus reticulata	Ref.
Plantae	Rutaceae	Citrus spp.	Ref.
Plantae	Solanaceae	Capsicum annuum L.	Ref.
Plantae	Solanaceae	Solanum tuberosum	Ref.
Plantae	Verbenaceae	Duranta repens	Ref.
Plantae	Zingiberaceae	Zingiber officinale	Ref.
-	-	Bangia fuscopurpurea	Ref.
-	-	Bonnemaisonia hamifera	Ref.
-	-	Gallus gallus domesticus	Ref.
-	-	Gigartina stellata	Ref.
-	-	Nemalion helminthoides	Ref.
-	-	Phodymenia palmata	Ref.
-	-	Staria italia	Ref.

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