input word = C00018612

Metabolite InformationStructural formula
Name Antibiotic TAN 547A
Chitinovorin A
Formula C26H41N9O11S
Mw 687.26462395
CAS RN 95041-98-8
C_ID C00018612 ,
InChIKey QIKMSWPGMFAWFV-UHFFFAOYNA-N
InChICode InChI=1S/C26H41N9O11S/c1-12(27)20(40)33-15(5-3-7-31-25(29)30)16(37)8-18(39)46-9-13-10-47-24-26(32-11-36,23(45)35(24)19(13)22(43)44)34-17(38)6-2-4-14(28)21(41)42/h11-12,14-16,24,37H,2-10,27-28H2,1H3,(H,32,36)(H,33,40)(H,34,38)(H,41,42)(H,43,44)(H4,29,30,31)/t12-,14-,15+,16+,24+,26+/m1/s1
SMILES [C@H]12N(C(=C(CS1)COC(=O)C[C@@H]([C@H](CCCNC(=N)N)NC(=O)[C@@H](C)N)O)C(=O)O)C(=O)[C@]2(NC=O)NC(=O)CCC[C@H](C(=O)O)N
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg
Organism
Kingdom Family Species Reference
BacteriaFlavobacteriaceaeFlavobacterium chitinovorum sp. nov. Ref.
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