input word = C00044325

Metabolite InformationStructural formula
Name Squamone
Formula C35H62O7
Mw 594.44955433
CAS RN 126655-24-1
C_ID C00044325 ,
InChIKey PAFMHAFYJMTISR-UHFFFAOYNA-N
InChICode InChI=1S/C35H62O7/c1-3-4-5-6-7-8-9-10-11-14-21-31(38)33-23-24-34(42-33)32(39)22-15-12-13-18-29(37)19-16-17-20-30-26-28(25-27(2)36)35(40)41-30/h28,30-34,38-39H,3-26H2,1-2H3/t28-,30+,31-,32-,33-,34+/m0/s1
SMILES CCCCCCCCCCCCC(O)C1CCC(C(O)CCCCCC(=O)CCCCC2CC(CC(C)=O)C(=O)O2)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeAnnona reticulata Ref.
PlantaeAnnonaceaeAnnona squamosa Ref.
zoom in



OrganismAnnona reticulata
ReferenceYu, et al., APS, 32, (1997), 914.

Chang, et al., JNP, 56, (1993), 1688.

Li, et al., JNP, 53, (1990), 81