input word = C00027941

Metabolite InformationStructural formula
Name Bistramide A
Bistratene A
Formula C40H68N2O8
Mw 704.49756716
CAS RN 115566-02-4
C_ID C00027941 ,
InChIKey JTYXFVLXXQMJHM-ARTXSTGPNA-N
InChICode InChI=1S/C40H68N2O8/c1-7-12-32(44)24-35-19-17-28(3)37(48-35)25-38(46)42-26-36(45)30(5)39(47)41-22-9-8-13-33-14-10-20-40(49-33)21-11-15-34(50-40)18-16-27(2)23-29(4)31(6)43/h7,12,23,27-28,30-31,33-37,43,45H,8-11,13-22,24-26H2,1-6H3,(H,41,47)(H,42,46)/b12-7+,29-23+/t27-,28-,30-,31-,33+,34-,35+,36-,37-,40-/m0/s1
SMILES C1C[C@H](O[C@@]2(C1)O[C@@H](CCC2)CCCCNC(=O)[C@H]([C@H](CNC(=O)C[C@H]1[C@H](CC[C@@H](O1)CC(=O)/C=C/C)C)O)C)CC[C@@H](/C=C(/[C@H](C)O)\C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg
Organism
Kingdom Family Species Reference
AnimaliaDidemnidaeLissoclinum bistratum Ref.
AnimaliaDidemnidaeTrididemnum cyclops Ref.
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