input word = C00018384

Metabolite InformationStructural formula
Name Trisarubicinol
Formula C40H51NO15
Mw 785.32586997
CAS RN 80470-08-2
C_ID C00018384 ,
InChIKey RFRIIINGCQOYCL-AIILURQWNA-N
InChICode InChI=1S/C40H51NO15/c1-16-23(43)10-11-27(51-16)55-39-18(3)53-29(13-25(39)45)56-38-17(2)52-28(12-22(38)41(5)6)54-26-15-40(50,19(4)42)14-21-31(26)37(49)33-32(35(21)47)34(46)20-8-7-9-24(44)30(20)36(33)48/h7-9,16-19,22,25-29,38-39,42,44-45,47,49-50H,10-15H2,1-6H3/t16-,17+,18-,19+,22-,25-,26-,27-,28-,29-,38-,39+,40-/m0/s1
SMILES C1[C@@](Cc2c([C@H]1O[C@@H]1O[C@@H]([C@@H]([C@H](C1)N(C)C)O[C@@H]1O[C@H]([C@@H](O[C@H]3CCC(=O)[C@@H](O3)C)[C@H](C1)O)C)C)c(c1c(c2O)C(=O)c2c(C1=O)c(ccc2)O)O)([C@@H](C)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Lys L-Arg L-Asp
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces galilaeus KE303 Ref.
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OrganismStreptomyces galilaeus KE303
ReferenceYoshimoto,J. Antibiotics,34,(1981),1492