input word = C00023062

Metabolite InformationStructural formula
Name Mytiloxanthinone
(3R,5'R)-7,8-Didehydro-3,8'-dihydroxy-beta,kappa-carotene-3',6'-dione
Formula C40H52O4
Mw 596.38656015
CAS RN 83746-66-1
C_ID C00023062 ,
InChIKey AEOORGIQHLESFZ-FAIJJFIFNA-N
InChICode InChI=1S/C40H52O4/c1-28(17-13-18-30(3)21-22-35-32(5)23-33(41)25-38(35,6)7)15-11-12-16-29(2)19-14-20-31(4)36(43)24-37(44)40(10)27-34(42)26-39(40,8)9/h11-20,24,33,41,43H,23,25-27H2,1-10H3/b12-11+,17-13+,19-14+,28-15+,29-16+,30-18+,31-20+,36-24-/t33-,40+/m1/s1
SMILES C1(=C(C[C@H](CC1(C)C)O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaBotryllidaeBotryllus schlosseri Ref.
AnimaliaStyelidaeStyela clava Ref.
AnimaliaStyelidaeStyela plicata Ref.
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