input word = C00037973

Metabolite InformationStructural formula
Name Unguisin B
Formula C37H56N8O7
Mw 724.4271962
CAS RN 226956-07-6
C_ID C00037973 ,
InChIKey DLGQVTFCVCCOEO-SVIHBFBONA-N
InChICode InChI=1S/C37H56N8O7/c1-9-21(6)31-37(52)44-29(19(2)3)35(50)41-23(8)32(47)42-27(17-24-18-39-26-14-11-10-13-25(24)26)34(49)38-16-12-15-28(46)40-22(7)33(48)43-30(20(4)5)36(51)45-31/h10-11,13-14,18-23,27,29-31,39H,9,12,15-17H2,1-8H3,(H,38,49)(H,40,46)(H,41,50)(H,42,47)(H,43,48)(H,44,52)(H,45,51)/t21-,22-,23-,27-,29-,30-,31+/m1/s1
SMILES C1(=O)[C@H](NC(=O)[C@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@H](NC(=O)CCCN1)C)C(C)C)[C@H](C)CC)C(C)C)C)Cc1c[nH]c2c1cccc2
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
--Emericella unguis Ref.
zoom in