input word = C00016264

Metabolite InformationStructural formula
Name BK 101C
N 4909
Formula C53H94N8O12
Mw 1034.69912053
CAS RN 173928-66-0
C_ID C00016264 ,
InChIKey UFXZNDDRRLHZPP-UAFFOGIWNA-N
InChICode InChI=1S/C53H94N8O12/c1-13-35(12)46-53(72)73-36(22-20-18-16-14-15-17-19-21-30(2)3)28-43(63)55-37(23-24-42(54)62)47(66)56-38(25-31(4)5)48(67)57-39(26-32(6)7)50(69)60-45(34(10)11)52(71)59-41(29-44(64)65)49(68)58-40(27-33(8)9)51(70)61-46/h30-41,45-46H,13-29H2,1-12H3,(H2,54,62)(H,55,63)(H,56,66)(H,57,67)(H,58,68)(H,59,71)(H,60,69)(H,61,70)(H,64,65)/t35-,36-,37+,38+,39-,40-,41+,45+,46-/m1/s1
SMILES C1(=O)[C@@H](NC(=O)C[C@H](OC(=O)[C@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](N1)CC(C)C)CC(C)C)C(C)C)CC(=O)O)CC(C)C)[C@H](C)CC)CCCCCCCCCC(C)C)CCC(=O)N
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Ala
Organism
Kingdom Family Species Reference
BacteriaBacillaceaeBacillus sp. No. 4691 Ref.
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