input word = C00030655

Metabolite InformationStructural formula
Name Leucastrin A
(+)-Leucastrin A
Formula C31H54O2
Mw 458.41238097
CAS RN 922706-19-2
C_ID C00030655 ,
InChIKey OJRFUDTXOBURFR-LZSSPRRHNA-N
InChICode InChI=1S/C31H54O2/c1-20(2)21(3)14-17-31(9,33)25-15-16-29(7)24-12-10-22-23(11-13-26(32)27(22,4)5)28(24,6)18-19-30(25,29)8/h21-26,32-33H,1,10-19H2,2-9H3/t21-,22+,23-,24-,25-,26-,28-,29+,30-,31-/m0/s1
SMILES C=C(C)[C@@H](C)CC[C@](C)(O)[C@H]1CC[C@]2(C)[C@H]3CC[C@@H]4[C@H](CC[C@H](O)C4(C)C)[C@]3(C)CC[C@@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeLeucas cephalotes SPRENG. Ref.
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