input word = C00003764

Metabolite InformationStructural formula
Name Capsorubin
Formula C40H56O4
Mw 600.41786028
CAS RN 470-38-2
C_ID C00003764 ,
InChIKey GVOIABOMXKDDGU-JLPNJUNVNA-N
InChICode InChI=1S/C40H56O4/c1-29(17-13-19-31(3)21-23-35(43)39(9)27-33(41)25-37(39,5)6)15-11-12-16-30(2)18-14-20-32(4)22-24-36(44)40(10)28-34(42)26-38(40,7)8/h11-24,33-34,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t33-,34-,39-,40-/m0/s1
SMILES 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(C(C[C@@H](C1)O)(C)C)C)\C)/C)/C)[C@]1(C(C[C@@H](C1)O)(C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLiliaceaeLilium pumilum Ref.
PlantaeSolanaceaeCapsicum annuum Ref.
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