input word = C00026690

Metabolite InformationStructural formula
Name Communesin E
(-)-Communesin E
Formula C27H30N4O2
Mw 442.23687623
CAS RN 727416-58-2
C_ID C00026690 ,
InChIKey XJXBCJLZWKPOFG-LDBMYMGHNA-N
InChICode InChI=1S/C27H30N4O2/c1-15(32)30-13-11-26-17-8-4-5-9-18(17)28-23-27(26)12-14-31(24(26)30)21(22-25(2,3)33-22)16-7-6-10-19(29-23)20(16)27/h4-10,21-24,28-29H,11-14H2,1-3H3/t21-,22+,23+,24+,26-,27-/m1/s1
SMILES c1ccc2c3c1[C@@H](N1[C@H]4[C@@]5([C@]3([C@H](N2)Nc2c5cccc2)CC1)CCN4C(=O)C)[C@@H]1OC1(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaePenicillium expansum MK-57 Ref.
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