input word = C00048207

Metabolite InformationStructural formula
Name Tirandamycin B
Formula C22H27NO8
Mw 433.17366685
CAS RN 60587-14-6
C_ID C00048207 ,
InChIKey LYJKREGDQDJIDC-BHHJBWQLNA-N
InChICode InChI=1S/C22H27NO8/c1-10(5-6-13(25)15-14(26)8-23-20(15)28)7-11(2)17-12(3)18-16(27)19-22(9-24,31-19)21(4,29-17)30-18/h5-7,11-12,17-19,24-25H,8-9H2,1-4H3,(H,23,28)/b6-5+,10-7+,15-13+/t11-,12+,17+,18-,19-,21-,22-/m1/s1
SMILES [C@@H]1([C@@H]([C@@H]2C(=O)[C@H]3O[C@]3([C@](O1)(O2)C)CO)C)[C@H](C)/C=C(\C)/C=C/C(=C/1\C(=O)NCC1=O)/O
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-His
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces sp. 307-9 Ref.
zoom in