input word = C00049019

Metabolite InformationStructural formula
Name trans-Isomurisolenin
Formula C34H60O6
Mw 564.43898965
CAS RN 208539-77-9
C_ID C00049019 ,
InChIKey BHKBAQOZVCASRP-DTQAZKPQNA-N
InChICode InChI=1S/C34H60O6/c1-3-4-5-6-7-8-12-15-18-21-30(36)32-23-24-33(40-32)31(37)22-19-16-13-10-9-11-14-17-20-29-26-28(25-27(2)35)34(38)39-29/h13,16,28-33,36-37H,3-12,14-15,17-26H2,1-2H3/b16-13+/t28-,29+,30+,31-,32-,33-/m1/s1
SMILES CCCCCCCCCCCC(O)C1CCC(C(O)CC/C=C/CCCCCCC2CC(CC(C)=O)C(=O)O2)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeAnnona reticulata Ref.
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