input word = C00019571

Metabolite InformationStructural formula
Name ADP-D-glycero-beta-D-manno-heptose
Formula C17H27N5O16P2
Mw 619.09280284
CAS RN 80186-87-4
C_ID C00019571 ,
InChIKey KMSFWBYFWSKGGR-GSLGOZQBNA-N
InChICode InChI=1S/C17H27N5O16P2/c18-14-7-15(20-3-19-14)22(4-21-7)16-11(28)8(25)6(35-16)2-34-39(30,31)38-40(32,33)37-17-12(29)9(26)10(27)13(36-17)5(24)1-23/h3-6,8-13,16-17,23-29H,1-2H2,(H,30,31)(H,32,33)(H2,18,19,20)/t5-,6+,8-,9+,10+,11-,12-,13+,16+,17+/m1/s1
SMILES O([P@@](=O)(O)O[P@](=O)(OC[C@H]1[C@@H](O)[C@@H](O)[C@@H](n2c3c(nc2)c(ncn3)N)O1)O)[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)[C@@H](CO)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Asp L-Phe
Organism
Kingdom Family Species Reference
BacteriaEnterobacteriaceaeEscherichia coli Ref.
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