(Q27461935)

(4R)-5-AMINO-4-[({3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN-4-YL}METHYL)AMINO]PENTANOIC ACID (English)

19 October 2016

chemical formula

C₁₃H₂₂N₃O₇P

1 reference

(4R)-5-AMINO-4-[({3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN-4-YL}METHYL)AMINO]PENTANOIC ACID (English)

19 October 2016

canonical SMILES

CC1=NC=C(C(=C1O)CNC(CCC(=O)O)CN)COP(=O)(O)O

1 reference

(4R)-5-AMINO-4-[({3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN-4-YL}METHYL)AMINO]PENTANOIC ACID (English)

19 October 2016

isomeric SMILES

CC1=NC=C(C(=C1O)CN[C@H](CCC(=O)O)CN)COP(=O)(O)O

1 reference

(4R)-5-AMINO-4-[({3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN-4-YL}METHYL)AMINO]PENTANOIC ACID (English)

InChI=1S/C13H22N3O7P/c1-8-13(19)11(6-16-10(4-14)2-3-12(17)18)9(5-15-8)7-23-24(20,21)22/h5,10,16,19H,2-4,6-7,14H2,1H3,(H,17,18)(H2,20,21,22)/t10-/m1/s1

19 October 2016

Identifiers

InChI

1 reference

(4R)-5-AMINO-4-[({3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN-4-YL}METHYL)AMINO]PENTANOIC ACID (English)

WQZRTAINNZJAQI-SNVBAGLBSA-N

19 October 2016

InChIKey

1 reference

(4R)-5-AMINO-4-[({3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN-4-YL}METHYL)AMINO]PENTANOIC ACID (English)

19 October 2016

2 references

(4R)-5-AMINO-4-[({3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN-4-YL}METHYL)AMINO]PENTANOIC ACID (English)

matched by identifier from

19 October 2016

InChIKey

WQZRTAINNZJAQI-SNVBAGLBSA-N

1 reference

0 references

1 reference

2HP2 (English)