input word = C00014964

Metabolite InformationStructural formula
Name SNA 60-367-10
Formula C74H114N12O20
Mw 1490.82723417
CAS RN 193738-73-7
C_ID C00014964 ,
InChIKey XNCGKJLFMNNROD-XIUCGAQONA-N
InChICode InChI=1S/C74H114N12O20/c1-7-43(4)20-16-14-12-10-11-13-15-17-21-49(89)42-60(91)77-53(33-36-61(92)93)66(97)79-52(22-18-38-75)65(96)82-57-41-47-26-30-50(31-27-47)106-74(105)63(44(5)8-2)84-69(100)56(40-46-24-28-48(88)29-25-46)83-68(99)54(32-35-59(76)90)80-71(102)58-23-19-39-86(58)73(104)51(9-3)78-67(98)55(34-37-62(94)95)81-72(103)64(45(6)87)85-70(57)101/h24-31,43-45,49,51-58,63-64,87-89H,7-23,32-42,75H2,1-6H3,(H2,76,90)(H,77,91)(H,78,98)(H,79,97)(H,80,102)(H,81,103)(H,82,96)(H,83,99)(H,84,100)(H,85,101)(H,92,93)(H,94,95)/t43-,44-,45-,49+,51-,52+,53-,54+,55-,56-,57+,58-,63+,64-/m0/s1
SMILES [C@@H]12N(C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](Cc3ccc(OC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@H](NC1=O)CCC(=O)N)Cc1ccc(cc1)O)[C@@H](C)CC)cc3)NC(=O)[C@@H](CCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)C[C@H](O)CCCCCCCCCC[C@H](CC)C)[C@H](C)O)CCC(=O)O)CC)CCC2
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys
Organism
Kingdom Family Species Reference
BacteriaBacillaceaeBacillus sp. SNA-60-367 Ref.
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