input word = C00023053

Metabolite InformationStructural formula
Name Capsanthone
Formula C40H54O3
Mw 582.40729559
CAS RN 28368-01-6
C_ID C00023053 ,
InChIKey RSVFJNWBMXVMGE-OCZQMLQXNA-N
InChICode InChI=1S/C40H54O3/c1-29(17-13-19-31(3)21-23-36-33(5)25-34(41)26-38(36,6)7)15-11-12-16-30(2)18-14-20-32(4)22-24-37(43)40(10)28-35(42)27-39(40,8)9/h11-24,34,41H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t34-,40+/m1/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(=O)[C@@]1(CC(=O)CC1(C)C)C)\C)\C)/C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSapindaceaeAesculus sp. Ref.
PlantaeSolanaceaeCapsicum annuum Ref.
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