input word = C00039673

Metabolite InformationStructural formula
Name Lyngbyastatin 7
Formula C48H66N8O12
Mw 946.48001963
CAS RN 957131-00-9
C_ID C00039673 ,
InChIKey DZIGKKCSWPSVIO-OHNRTRDINA-N
InChICode InChI=1S/C48H66N8O12/c1-7-9-11-16-38(59)50-33(21-23-37(49)58)43(62)54-41-28(5)68-48(67)40(27(3)4)53-44(63)35(25-30-17-19-31(57)20-18-30)55(6)47(66)36(26-29-14-12-10-13-15-29)56-39(60)24-22-34(46(56)65)52-42(61)32(8-2)51-45(41)64/h8,10,12-15,17-20,27-28,33-36,39-41,57,60H,7,9,11,16,21-26H2,1-6H3,(H2,49,58)(H,50,59)(H,51,64)(H,52,61)(H,53,63)(H,54,62)/b32-8-/t28-,33+,34+,35+,36+,39-,40+,41+/m1/s1
SMILES C1C[C@H](N2[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)O[C@@H]([C@@H](C(=O)N/C(=C\C)/C(=O)N[C@@H]1C2=O)NC(=O)[C@@H](NC(=O)CCCCC)CCC(=O)N)C)C(C)C)Cc1ccc(cc1)O)C)Cc1ccccc1)O
Start Substs in Alk. Biosynthesis (Prediction) L-Lys
Organism
Kingdom Family Species Reference
--Lyngbya majuscula Ref.
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OrganismLyngbya majuscula
ReferenceTaori,J.Nat.Prod.,70,(2007),1593