input word = C00024044

Metabolite InformationStructural formula
Name Antiquol A
Formula C39H58O3
Mw 574.43859572
CAS RN 129317-83-5
C_ID C00024044 ,
InChIKey VNLXUAZIWQQYHP-XPNBWRKZNA-N
InChICode InChI=1S/C39H58O3/c1-27(2)13-12-23-39(8,41)32-21-26-37(6)30-17-18-31-35(3,4)33(42-34(40)19-16-28-14-10-9-11-15-28)22-24-36(31,5)29(30)20-25-38(32,37)7/h9-11,13-16,19,29-33,41H,12,17-18,20-26H2,1-8H3/b19-16+/t29-,30+,31-,32-,33-,36+,37-,38+,39+/m0/s1
SMILES C1[C@@H](C([C@H]2[C@](C1)([C@@H]1[C@@H](CC2)[C@]2([C@](CC1)([C@H](CC2)[C@](CCC=C(C)C)(C)O)C)C)C)(C)C)OC(=O)/C=C/c1ccccc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeEuphorbia antiquorum L. Ref.
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OrganismEuphorbia antiquorum L.
ReferenceGewali M.B.,Phytochem.,29,(1990),1625-1628