input word = C00034443

Metabolite InformationStructural formula
Name Aurilide B
(-)-Aurilide B
Formula C44H75N5O10
Mw 833.55139365
CAS RN 881922-31-2
C_ID C00034443 ,
InChIKey LRWWIPZJXHBJSP-YLLNERKKNA-N
InChICode InChI=1S/C44H75N5O10/c1-17-20-28(10)37-30(12)32(50)22-21-29(11)43(56)59-38(27(9)19-3)39(52)46-35(25(6)7)41(54)49(16)36(26(8)18-2)42(55)47(14)23-33(51)45-34(24(4)5)40(53)48(15)31(13)44(57)58-37/h20-21,24-27,30-32,34-38,50H,17-19,22-23H2,1-16H3,(H,45,51)(H,46,52)/b28-20+,29-21+/t26-,27+,30+,31+,32+,34+,35+,36+,37-,38-/m1/s1
SMILES [C@H]1([C@H](OC(=O)[C@@H](N(C(=O)[C@@H](NC(=O)CN(C(=O)[C@@H](N(C(=O)[C@@H](NC(=O)[C@H](OC(=O)/C(=C/C[C@@H]1O)/C)[C@H](CC)C)C(C)C)C)[C@@H](CC)C)C)C(C)C)C)C)/C(=C/CC)/C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-Ala
Organism
Kingdom Family Species Reference
--Lyngbya majuscula Ref.
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OrganismLyngbya majuscula
ReferenceTan,Phytochem.,68,(2007),954