Chemical Component Summary

NameprFMN cofactor and cinnamic acid adduct
FormulaC30 H37 N4 O9 P
Molecular Weight628.61
TypeNON-POLYMER
Isomeric SMILESCc1cc2c3c(c1C)C(C[C@@H]4[N@]3[C@]5([C@@H](C4)c6ccccc6)C(=O)NC(=O)N=C5N2C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O)(C)C
InChIInChI=1S/C30H37N4O9P/c1-15-10-20-24-23(16(15)2)29(3,4)12-18-11-19(17-8-6-5-7-9-17)30(34(18)24)26(31-28(39)32-27(30)38)33(20)13-21(35)25(37)22(36)14-43-44(40,41)42/h5-10,18-19,21-22,25,35-37H,11-14H2,1-4H3,(H,32,38,39)(H2,40,41,42)/t18-,19+,21+,22-,25+,30+/m1/s1
InChIKeyWCKFFLZBWSLRDK-BEFVXGCNSA-N

Chemical Details

Formal Charge0
Atom Count81
Chiral Atom Count7
Bond Count86
Aromatic Bond Count12

Related Resource References

Resource NameReference
PubChem 138857935