input word = C00034685

Metabolite InformationStructural formula
Name Somamide A
(-)-Somamide A
Formula C48H67N7O12S
Mw 965.45684139
CAS RN 350811-51-7
C_ID C00034685 ,
InChIKey YJIIXVAOLGKWSK-IOBDTDCANA-N
InChICode InChI=1S/C48H67N7O12S/c1-8-10-12-17-38(57)49-34(24-25-68(7)66)43(60)53-41-29(5)67-48(65)40(28(3)4)52-44(61)36(26-31-18-20-32(56)21-19-31)54(6)47(64)37(27-30-15-13-11-14-16-30)55-39(58)23-22-35(46(55)63)51-42(59)33(9-2)50-45(41)62/h9,11,13-16,18-21,28-29,34-37,39-41,56,58H,8,10,12,17,22-27H2,1-7H3,(H,49,57)(H,50,62)(H,51,59)(H,52,61)(H,53,60)/b33-9-/t29-,34+,35+,36+,37+,39-,40+,41+,68+/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)CC[S@@](=O)C)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 x Schizothrix sp. Ref.
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