input word = C00016275

Metabolite InformationStructural formula
Name Halymecin C
Formula C32H58O11
Mw 618.3979127
CAS RN 167173-82-2
C_ID C00016275 ,
InChIKey VKMYCUDYNRAXCY-ZNGVSISPNA-N
InChICode InChI=1S/C32H58O11/c1-5-8-11-14-24(34)17-25(35)20-31(39)43-28(16-13-10-7-3)21-29(41-23(4)33)22-32(40)42-27(15-12-9-6-2)18-26(36)19-30(37)38/h24-29,34-36H,5-22H2,1-4H3,(H,37,38)/t24-,25-,26+,27+,28-,29+/m0/s1
SMILES C([C@@H](CC(=O)O[C@@H](CCCCC)C[C@@H](OC(=O)C)CC(=O)O[C@H](CCCCC)C[C@H](CC(=O)O)O)O)[C@H](CCCCC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiNectriaceaeFusarium sp. FE-71-1 Ref.
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OrganismFusarium sp. FE-71-1
ReferenceChen,J. Antibiotics,49,(1996),998