input word = C00007263

Metabolite InformationStructural formula
Name Cinnamoyl-CoA
Formula C30H42N7O17P3S
Mw 897.15707317
CAS RN
C_ID C00007263 ,
InChIKey JVNVHNHITFVWIX-CMDGGOBGNA-N
InChICode InChI=1S/C30H42N7O17P3S/c1-30(2,25(41)28(42)33-11-10-20(38)32-12-13-58-21(39)9-8-18-6-4-3-5-7-18)15-51-57(48,49)54-56(46,47)50-14-19-24(53-55(43,44)45)23(40)29(52-19)37-17-36-22-26(31)34-16-35-27(22)37/h3-9,16-17,19,23-25,29,40-41H,10-15H2,1-2H3,(H,32,38)(H,33,42)(H,46,47)(H,48,49)(H2,31,34,35)(H2,43,44,45)/b9-8+/t19-,23+,24+,25+,29+/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)/C=C/c1ccccc1)O)(C)C)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp L-Pro L-Asp IPP
Organism
Kingdom Family Species Reference
PlantaeCaricaceaeCarica papaya Ref.
PlantaePoaceaeSorghum bicolor Ref.
PlantaeZingiberaceaeZingiber officinale Ref.
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