input word = C00031773

Metabolite InformationStructural formula
Name Erinacerin A
Formula C27H31NO4
Mw 433.22530849
CAS RN 870193-54-7
C_ID C00031773 ,
InChIKey VSETXQQLPHMGQF-UHFFFAOYNA-N
InChICode InChI=1S/C27H31NO4/c1-18(2)14-20(29)16-27(3)12-10-21-24(31-4)15-22-23(25(21)32-27)17-28(26(22)30)13-11-19-8-6-5-7-9-19/h5-9,14-15H,10-13,16-17H2,1-4H3/t27-/m0/s1
SMILES c12c(cc(c3c1O[C@](CC3)(C)CC(=O)C=C(C)C)OC)C(=O)N(C2)CCc1ccccc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiHericiaceaeHericium erinaceum (Bull:FR.) Ref.
zoom in