input word = C00018208

Metabolite InformationStructural formula
Name Epicorazine B
Formula C18H16N2O6S2
Mw 420.04497772
CAS RN 69176-72-3
C_ID C00018208 ,
InChIKey RCODXLGTKJXDNC-UHFFFAOYNA-N
InChICode InChI=1S/C18H16N2O6S2/c21-9-1-3-11(23)13-7(9)5-17-15(25)20-14-8(10(22)2-4-12(14)24)6-18(20,28-27-17)16(26)19(13)17/h1-4,7-8,11-14,23-24H,5-6H2/t7-,8-,11-,12+,13-,14-,17-,18-/m0/s1
SMILES C1=C[C@H]([C@@H]2[C@H](C1=O)C[C@@]13N2C(=O)[C@@]2(N(C1=O)[C@H]1[C@@H](C2)C(=O)C=C[C@@H]1O)SS3)O
Start Substs in Alk. Biosynthesis (Prediction) L-Lys L-Arg L-Asp
Organism
Kingdom Family Species Reference
FungiIncertae sedisEpicoccum nigrum 751-5 Ref.
zoom in