input word = C00022805

Metabolite InformationStructural formula
Name Tethyatene
3,4-Didehydro-beta,khi-carotene
Formula C40H50
Mw 530.39125159
CAS RN 65252-69-9
C_ID C00022805 ,
InChIKey MMDGAHBFSCOGTN-GEWAIPMNSA-N
InChICode InChI=1S/C40H50/c1-30(18-13-20-32(3)23-26-38-27-25-34(5)36(7)37(38)8)16-11-12-17-31(2)19-14-21-33(4)24-28-39-35(6)22-15-29-40(39,9)10/h11-28H,29H2,1-10H3/b12-11+,18-13+,19-14+,26-23+,28-24+,30-16+,31-17+,32-20+,33-21+
SMILES C(=C\C1=C(C=CCC1(C)C)C)/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/c1c(c(c(cc1)C)C)C)\C)\C)/C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaTethyidaeTethya amanensis Ref.
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