input word = C00017581

Metabolite InformationStructural formula
Name Pumilacidin G
Formula C54H95N7O13
Mw 1049.69878617
CAS RN 128422-74-2
C_ID C00017581 ,
InChIKey JXQMRYDMEYOLDL-UHFFFAOYNA-N
InChICode InChI=1S/C54H95N7O13/c1-12-13-14-15-16-17-18-19-20-21-22-23-37-30-44(62)55-38(24-25-45(63)64)48(67)56-39(26-32(2)3)49(68)57-40(27-33(4)5)50(69)58-41(28-34(6)7)51(70)60-43(31-46(65)66)52(71)59-42(29-35(8)9)53(72)61-47(36(10)11)54(73)74-37/h32-43,47H,12-31H2,1-11H3,(H,55,62)(H,56,67)(H,57,68)(H,58,69)(H,59,71)(H,60,70)(H,61,72)(H,63,64)(H,65,66)/t37-,38+,39-,40-,41-,42+,43+,47+/m1/s1
SMILES N1[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@@H](C1=O)CC(C)C)CC(C)C)CC(C)C)CCC(=O)O)CCCCCCCCCCCCC)C(C)C)CC(C)C)CC(=O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Ala
Organism
Kingdom Family Species Reference
BacteriaBacillaceaeBacillus pumilus M937-B1 Ref.
zoom in