input word = C00012611

Metabolite InformationStructural formula
Name (2'S,3'R,12'S)-13'-Deoxy-2',3'-epoxy-2',3',7',8'-tetrahydro-13'-oxo-satratoxin H
Mytoxin C
Formula C29H36O10
Mw 544.23084737
CAS RN 105118-81-8
C_ID C00012611 ,
InChIKey DRZCTJUHSSLCEB-JWDIRTTPNA-N
InChICode InChI=1S/C29H36O10/c1-16-7-9-26-14-34-23(32)22-28(39-22)10-11-35-27(17(2)30,24(28)33)8-5-4-6-21(31)38-18-13-20(37-19(26)12-16)29(15-36-29)25(18,26)3/h4,6,12,18-20,22,24,33H,5,7-11,13-15H2,1-3H3/b6-4-/t18-,19-,20-,22-,24-,25-,26-,27+,28?,29+/m1/s1
SMILES CC(=O)C12CC/C=CC(=O)O[C@@H]3C[C@H]4O[C@@H]5C=C(C)CC[C@]5(COC(=O)[C@H]5O[C@]5(CCO1)[C@@H]2O)C3(C)[C@]41CO1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiIncertae sedisMyrothecium roridum Ref.
zoom in