input word = C00048858

Metabolite InformationStructural formula
Name Spirotryprostatin C
(-)-Spirotryprostatin C
Formula C27H33N3O6
Mw 495.23693581
CAS RN 1064063-48-4
C_ID C00048858 ,
InChIKey YPSDDVCGIHETLQ-WQTWIUDHNA-N
InChICode InChI=1S/C27H33N3O6/c1-15(2)10-12-29-20-14-17(36-5)8-9-18(20)26(24(29)33)21(13-16(3)4)30-22(31)19-7-6-11-28(19)25(34)27(30,35)23(26)32/h8-10,13-14,19,21,23,32,35H,6-7,11-12H2,1-5H3/t19-,21-,23-,26-,27+/m0/s1
SMILES COc1ccc2c(c1)N(CC=C(C)C)C(=O)[C@]21[C@H](C=C(C)C)N2C(=O)[C@@H]3CCCN3C(=O)[C@]2(O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus fumigatus Ref.
zoom in