input word = C00017904

Metabolite InformationStructural formula
Name Antibiotic MM 44787
MM 44787
Formula C26H28O12
Mw 532.15807636
CAS RN 115178-41-1
C_ID C00017904 ,
InChIKey HHZJRUQBPXYJQB-UHFFFAOYNA-N
InChICode InChI=1S/C26H28O12/c1-9-12(27)6-7-16(36-9)38-14-8-13-17-20(26(14,35)10(2)37-13)24(33)19-18(23(17)32)21(30)11(22(31)25(19)34)4-3-5-15(28)29/h3-4,9-10,12-14,16,27,31-33,35H,5-8H2,1-2H3,(H,28,29)/b4-3+/t9-,10-,12+,13+,14+,16+,26+/m0/s1
SMILES C(=C\CC(=O)O)/C1=C(O)C(=O)c2c(C1=O)c(c1c(c2O)[C@]2([C@@H](O[C@@H]1C[C@H]2O[C@@H]1CC[C@H]([C@@H](O1)C)O)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces lateritius ATCC 19913 Ref.
zoom in