input word = C00015044

Metabolite InformationStructural formula
Name A 21459B
Argyrin A
Formula C40H44N10O8S
Mw 824.30642919
CAS RN 174423-37-1
C_ID C00015044 ,
InChIKey MXGWDBFUMHUPTG-UHFFFAOYNA-N
InChICode InChI=1S/C40H44N10O8S/c1-20-35(53)46-22(3)40(57)50(4)18-33(52)45-21(2)39-49-30(19-59-39)38(56)48-29(13-23-15-41-26-10-7-6-9-25(23)26)37(55)47-28(36(54)43-17-32(51)44-20)14-24-16-42-27-11-8-12-31(58-5)34(24)27/h6-12,15-16,19-21,28-29,41-42H,3,13-14,17-18H2,1-2,4-5H3,(H,43,54)(H,44,51)(H,45,52)(H,46,53)(H,47,55)(H,48,56)/t20-,21-,28+,29-/m0/s1
SMILES N1CC(=O)N[C@H](C(=O)NC(=C)C(=O)N(CC(=O)N[C@H](c2nc(C(=O)N[C@H](C(=O)N[C@@H](C1=O)Cc1c[nH]c3c1c(ccc3)OC)Cc1c3c([nH]c1)cccc3)cs2)C)C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate IPP
Organism
Kingdom Family Species Reference
PlantaeMenispermaceaeArchangium gephyra Ar 8082 Ref.
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