input word = C00026879

Metabolite InformationStructural formula
Name Apicidin A
Formula C33H47N5O5
Mw 593.35771965
CAS RN 183506-67-4
C_ID C00026879 ,
InChIKey BHYPIIUJEQHYIP-DJTCWABONA-N
InChICode InChI=1S/C33H47N5O5/c1-4-21(3)29-33(43)38-18-12-11-17-28(38)32(42)35-26(16-8-6-7-13-23(39)5-2)30(40)36-27(31(41)37-29)19-22-20-34-25-15-10-9-14-24(22)25/h9-10,14-15,20-21,26-29,34H,4-8,11-13,16-19H2,1-3H3,(H,35,42)(H,36,40)(H,37,41)/t21-,26-,27-,28+,29+/m0/s1
SMILES [C@H]1(NC(=O)[C@@H](NC(=O)[C@@H]2N(C(=O)[C@H](NC1=O)[C@H](CC)C)CCCC2)CCCCCC(=O)CC)Cc1c2c([nH]c1)cccc2
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
FungiNectriaceaeFusarium pallidoroseum Ref.
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