input word = C00011308

Metabolite InformationStructural formula
Name Chaetoglobosin B
Formula C32H36N2O5
Mw 528.26242227
CAS RN 50335-04-1
C_ID C00011308 ,
InChIKey VUEFRYQBOMQOMV-FLJFJQNPNA-N
InChICode InChI=1S/C32H36N2O5/c1-17-8-7-10-23-30(38)20(4)19(3)28-25(15-21-16-33-24-11-6-5-9-22(21)24)34-31(39)32(23,28)27(36)13-12-26(35)29(37)18(2)14-17/h5-7,9-14,16-17,23,25,28-30,33,37-38H,8,15H2,1-4H3,(H,34,39)/b10-7+,13-12+,18-14+/t17-,23?,25-,28-,29+,30+,32-/m0/s1
SMILES c1c2c(ccc1)c(c[nH]2)C[C@@H]1NC(=O)[C@@]23C(=O)/C=C/C(=O)[C@@H](/C(=C/[C@H](C/C=C/[C@H]3[C@@H](C(=C([C@@H]12)C)C)O)C)/C)O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
FungiChaetomiaceaeChaetomium cochlioides Ref.
FungiChaetomiaceaeChaetomium globosum Ref.
FungiChaetomiaceaeChaetomium mollipilium Ref.
FungiChaetomiaceaeChaetomium rectum Ref.
FungiChaetomiaceaeChaetomium subaffine Ref.
zoom in