input word = C00023102

Metabolite InformationStructural formula
Name Gelliodesxanthin
3',4'-Didehydro-3-hydroxy-4-oxo-2'-apo-beta,psi-carotenal
Formula C37H46O3
Mw 538.34469533
CAS RN 111536-19-7
C_ID C00023102 ,
InChIKey VFPVMIPMYVASLR-TUCGVVRANA-N
InChICode InChI=1S/C37H46O3/c1-28(17-11-19-30(3)20-12-21-31(4)23-14-26-38)15-9-10-16-29(2)18-13-22-32(5)24-25-34-33(6)36(40)35(39)27-37(34,7)8/h9-26,35,39H,27H2,1-8H3/b10-9+,17-11+,18-13+,20-12+,23-14+,25-24+,28-15+,29-16+,30-19+,31-21+,32-22+/t35-/m1/s1
SMILES C(=C\C(=C\C=C\C(=C\C=C\C=C(\C=C\C=C(\C=C\C=C(/C)\C=C\C=O)/C)/C)\C)\C)\C1=C(C(=O)[C@@H](CC1(C)C)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Gelliodes callista Ref.
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OrganismGelliodes callista
ReferenceTanaka,Bull. Jap. Soc. Sci. Fish.,53,(1987),1271