input word = C00029164

Metabolite InformationStructural formula
Name Ulithiacyclamide F
Formula C35H42N8O7S4
Mw 814.20592868
CAS RN 218916-93-9
C_ID C00029164 ,
InChIKey YASDULZMSFBKMX-PHZMWKQUNA-N
InChICode InChI=1S/C35H42N8O7S4/c1-5-16(2)25-35-40-22(13-52-35)29(46)38-24-15-54-53-14-23(30(47)42-26(17(3)44)31(48)41-25)37-28(45)21-12-51-34(39-21)20(11-19-9-7-6-8-10-19)36-32(49)27-18(4)50-33(24)43-27/h6-10,12-13,16-18,20,23-27,44H,5,11,14-15H2,1-4H3,(H,36,49)(H,37,45)(H,38,46)(H,41,48)(H,42,47)/t16-,17-,18-,20-,23+,24+,25-,26+,27+/m1/s1
SMILES CCC(C)[C@H]1NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@@H]2CSSC[C@H](NC(=O)c3csc1n3)C1=N[C@H](C(=O)N[C@H](Cc3ccccc3)c3nc(cs3)C(=O)N2)[C@@H](C)O1
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
AnimaliaDidemnidaeLissoclinum patella Ref.
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