input word = C00054690

Metabolite InformationStructural formula
Name Capsochrome
Formula C40H56O4
Mw 600.41786028
CAS RN 104012-89-7
C_ID C00054690
InChIKey WPXHAEKYWJBTNX-TYRVLMSXSA-N
InChICode InChI=1S/C40H56O4/c1-28(17-13-18-30(3)21-22-36(43)39(9)26-33(42)25-38(39,7)8)15-11-12-16-29(2)19-14-20-31(4)34-23-35-37(5,6)24-32(41)27-40(35,10)44-34/h11-23,32-34,41-42H,24-27H2,1-10H3/b12-11+,17-13+,19-14+,22-21+,28-15+,29-16+,30-18+,31-20+/t32-,33-,34-,39-,40+/m0/s1
SMILES C/C([C@H]1O[C@]2(C)C[C@@H](O)CC(C)(C)C2=C1)=CC=CC(C)=CC=CC=C(C)C=CC=C(C=CC([C@@]3(C)C(C)(C)C[C@H](O)C3)=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeCapsicum annuum Ref.
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