input word = C00014997

Metabolite InformationStructural formula
Name Pseudoalterobactin A
Formula C41H63N11O21S
Mw 1077.39206889
CAS RN 691850-60-9
C_ID C00014997 ,
InChIKey ULYRNACUAOJJBY-UHFFFAOYNA-N
InChICode InChI=1S/C41H63N11O21S/c42-12-4-1-8-21-36(63)51-28(32(59)40(67)68)38(65)47-17-27(56)45-13-6-3-9-20(35(62)49-21)50-39(66)29(33(60)41(69)70)52-37(64)22(15-25(44)54)48-26(55)16-23(53)19(43)7-2-5-14-46-34(61)18-10-11-24(74(71,72)73)31(58)30(18)57/h10-11,19-23,28-29,32-33,53,57-60H,1-9,12-17,42-43H2,(H2,44,54)(H,45,56)(H,46,61)(H,47,65)(H,48,55)(H,49,62)(H,50,66)(H,51,63)(H,52,64)(H,67,68)(H,69,70)(H,71,72,73)/t19-,20-,21-,22+,23-,28-,29-,32-,33+/m1/s1
SMILES c1(c(ccc(c1O)C(=O)NCCCC[C@@H](N)[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@@H]1CCCCNC(=O)CNC(=O)[C@H](NC(=O)[C@H](NC1=O)CCCCN)[C@H](C(=O)O)O)[C@H](O)C(=O)O)CC(=O)N)O)S(=O)(=O)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys
Organism
Kingdom Family Species Reference
BacteriaAlteromonadaceaePseudoalteromonas sp. KP20-4 Ref.
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