input word = C00007260

Metabolite InformationStructural formula
Name Malonyl CoA
Malonyl-CoA
Formula C24H38N7O19P3S
Mw 853.11560229
CAS RN 524-14-1
C_ID C00007260 ,
InChIKey LTYOQGRJFJAKNA-UHFFFAOYNA-N
InChICode InChI=1S/C24H38N7O19P3S/c1-24(2,19(37)22(38)27-4-3-13(32)26-5-6-54-15(35)7-14(33)34)9-47-53(44,45)50-52(42,43)46-8-12-18(49-51(39,40)41)17(36)23(48-12)31-11-30-16-20(25)28-10-29-21(16)31/h10-12,17-19,23,36-37H,3-9H2,1-2H3,(H,26,32)(H,27,38)(H,33,34)(H,42,43)(H,44,45)(H2,25,28,29)(H2,39,40,41)/t12-,17+,18+,19+,23-/m0/s1
SMILES n1cnc2c(c1N)ncn2[C@H]1O[C@H]([C@H]([C@H]1O)OP(=O)(O)O)CO[P@@](=O)(O[P@@](=O)(OCC([C@@H](C(=O)NCCC(=O)NCCSC(=O)CC(=O)O)O)(C)C)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp L-Pro
Organism
Kingdom Family Species Reference
PlantaeCruciferaeArabidopsis thaliana Ref.
PlantaePoaceaeSorghum bicolor Ref.
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OrganismArabidopsis thaliana
ReferenceSaslowsky,Plant J.,2001,27,37