input word = C00024087

Metabolite InformationStructural formula
Name Isobalaendiol
Formula C28H36O4
Mw 436.26135964
CAS RN 126594-34-1
C_ID C00024087 ,
InChIKey XIOIYRAFJRKQEJ-LYFZUNJLNA-N
InChICode InChI=1S/C28H36O4/c1-14-11-21-27(5)10-9-26(4)18(8-7-17-16(3)24(31)20(29)12-19(17)26)22(27)15(2)13-28(21,6)25(32)23(14)30/h7-8,12,14,21,23,25,30-32H,9-11,13H2,1-6H3/t14-,21-,23+,25+,26+,27-,28+/m0/s1
SMILES C1(=O)C(=C(C2=CC=C3[C@](C2=C1)(CC[C@@]1(C3=C(C[C@@]2([C@H]1C[C@@H]([C@H]([C@H]2O)O)C)C)C)C)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeElaeodendron balae KOSTERM. Ref.
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OrganismElaeodendron balae KOSTERM.
ReferenceFernando H.C.,Tetrahedron,45,(1989),5867-5876

Tezuka,Phytochem.,32,(1993),1531-1534