input word = C00011297

Metabolite InformationStructural formula
Name Fumitremorgin B
Formula C27H33N3O5
Mw 479.24202119
CAS RN 12626-17-4
C_ID C00011297 ,
InChIKey WEIYXEFMCIRZHC-SUYQZWKZNA-N
InChICode InChI=1S/C27H33N3O5/c1-15(2)10-12-28-20-14-17(35-5)8-9-18(20)22-23(28)21(13-16(3)4)30-25(32)19-7-6-11-29(19)26(33)27(30,34)24(22)31/h8-10,13-14,19,21,24,31,34H,6-7,11-12H2,1-5H3/t19-,21-,24-,27+/m0/s1
SMILES COc1ccc2c3c(n(CC=C(C)C)c2c1)[C@H](C=C(C)C)N1C(=O)[C@@H]2CCCN2C(=O)[C@]1(O)[C@H]3O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus caespitosus Ref.
FungiTrichocomaceaeAspergillus fumigatus Ref.
FungiTrichocomaceaePenicillium janthinellum Ref.
FungiTrichocomaceaePenicillium lanosum Ref.
FungiTrichocomaceaePenicillium piscarium Ref.
--Neosartaria fischeri Ref.
zoom in