input word = C00036894

Metabolite InformationStructural formula
Name Chamone II
Formula C38H48O4
Mw 568.35526002
CAS RN 309958-52-9
C_ID C00036894 ,
InChIKey NCEYXZCRXMSOBB-UHFFFAOYNA-N
InChICode InChI=1S/C38H48O4/c1-24(2)16-18-28(26(5)6)22-37-23-29(19-17-25(3)4)36(9,10)38(34(37)41,31(39)27-14-12-11-13-15-27)33-30(32(37)40)20-21-35(7,8)42-33/h11-17,20-21,28-29H,5,18-19,22-23H2,1-4,6-10H3/t28-,29-,37+,38-/m1/s1
SMILES C12=C([C@]3(C([C@@H](C[C@@](C1=O)(C3=O)C[C@H](C(=C)C)CC=C(C)C)CC=C(C)C)(C)C)C(=O)c1ccccc1)OC(C=C2)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeClusiaceae/Clusiaceae-GuttiferaeClusia grandiflora Ref.
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OrganismClusia grandiflora
ReferenceLokvam,Phytochem.,55,(2000),29