input word = C00026625

Metabolite InformationStructural formula
Name Chetoseminudin A
Formula C31H30N6O6S5
Mw 742.08303639
CAS RN 658711-86-5
C_ID C00026625 ,
InChIKey DIUIQJFZKRAGBZ-NGXPOVCFNA-N
InChICode InChI=1S/C31H30N6O6S5/c1-33-25(42)30(15-38)34(2)23(40)28(33,44-45-30)12-17-13-36(21-11-7-4-8-18(17)21)27-14-29-24(41)35(3)31(16-39,47-48-46-29)26(43)37(29)22(27)32-20-10-6-5-9-19(20)27/h4-11,13,22,32,38-39H,12,14-16H2,1-3H3/t22-,27+,28+,29+,30+,31+/m1/s1
SMILES c12c(cccc1)n(cc2C[C@@]12N(C(=O)[C@@](N(C1=O)C)(SS2)CO)C)[C@@]12c3c(cccc3)N[C@@H]1N1[C@@]3(C2)SSS[C@](C1=O)(CO)N(C3=O)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
FungiChaetomiaceaeChaetomium seminudum Ref.
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