Chemical Component Summary

NameN-({4-[{[(2R,4S,4aR,6S,8aS)-2-amino-4-hydroxydecahydropteridin-6-yl]methyl}(formyl)amino]phenyl}carbonyl)-D-glutamic acid
Identifiers(2R)-2-[[4-[[(2R,4S,4aR,6S,8aS)-2-amino-4-hydroxy-1,2,3,4,4a,5,6,7,8,8a-decahydropteridin-6-yl]methyl-methanoyl-amino]phenyl]carbonylamino]pentanedioic acid
FormulaC20 H29 N7 O7
Molecular Weight479.487
TypeNON-POLYMER
Isomeric SMILESc1cc(ccc1C(=O)N[C@H](CCC(=O)O)C(=O)O)N(C[C@@H]2CN[C@@H]3[C@@H](N2)[C@@H](N[C@@H](N3)N)O)C=O
InChIInChI=1S/C20H29N7O7/c21-20-25-16-15(18(32)26-20)23-11(7-22-16)8-27(9-28)12-3-1-10(2-4-12)17(31)24-13(19(33)34)5-6-14(29)30/h1-4,9,11,13,15-16,18,20,22-23,25-26,32H,5-8,21H2,(H,24,31)(H,29,30)(H,33,34)/t11-,13+,15+,16-,18-,20+/m0/s1
InChIKeyVSNRWTPIADGZQS-GVIHMSOPSA-N

Chemical Details

Formal Charge0
Atom Count63
Chiral Atom Count6
Bond Count65
Aromatic Bond Count6

Related Resource References

Resource NameReference
PubChem 42647300