input word = C00031956

Metabolite InformationStructural formula
Name Komodoquinone A
Formula C27H31NO10
Mw 529.19479622
CAS RN 630094-57-4
C_ID C00031956 ,
InChIKey QHKOGJYMAOSTLN-DSNKLVIENA-N
InChICode InChI=1S/C27H31NO10/c1-10-20(30)19(28(3)4)25(35)26(37-10)38-14-7-5-6-11-16(14)24(34)18-17(21(11)31)22(32)12-8-27(2,36)9-13(29)15(12)23(18)33/h5-7,10,13,19-20,25-26,29-30,32-33,35-36H,8-9H2,1-4H3/t10-,13-,19+,20+,25-,26-,27-/m0/s1
SMILES C[C@@H]1O[C@@H](Oc2cccc3c2C(=O)c2c(O)c4c(c(O)c2C3=O)C[C@](C)(O)C[C@@H]4O)[C@@H](O)[C@H](N(C)C)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces sp. KS3 Ref.
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