(5R,6R,8S)-8-(3-{[amino(imino)methyl]amino}phenyl)-5-cyclohexyl-6-hydroxy-3-oxo-1-phenyl-2,7-dioxa-4-aza-6-phosphanonan-9-oic acid 6-oxide (Q27454312)

(5r,6r,8s)-8-(3-{[amino(Imino)methyl]amino}phenyl)-5-Cyclohexyl-6-Hydroxy-3-Oxo-1-Phenyl-2,7-Dioxa-4-Aza-6-Phosphanonan-9-Oic Acid 6-Oxide (English)

19 October 2016

chemical formula

C₂₄H₃₁N₄O₇P

1 reference

(5r,6r,8s)-8-(3-{[amino(Imino)methyl]amino}phenyl)-5-Cyclohexyl-6-Hydroxy-3-Oxo-1-Phenyl-2,7-Dioxa-4-Aza-6-Phosphanonan-9-Oic Acid 6-Oxide (English)

19 October 2016

canonical SMILES

C1CCC(CC1)C(NC(=O)OCC2=CC=CC=C2)P(=O)(O)OC(C3=CC(=CC=C3)N=C(N)N)C(=O)O

1 reference

(5r,6r,8s)-8-(3-{[amino(Imino)methyl]amino}phenyl)-5-Cyclohexyl-6-Hydroxy-3-Oxo-1-Phenyl-2,7-Dioxa-4-Aza-6-Phosphanonan-9-Oic Acid 6-Oxide (English)

19 October 2016

isomeric SMILES

C1CCC(CC1)[C@H](NC(=O)OCC2=CC=CC=C2)P(=O)(O)O[C@@H](C3=CC(=CC=C3)N=C(N)N)C(=O)O

1 reference

(5r,6r,8s)-8-(3-{[amino(Imino)methyl]amino}phenyl)-5-Cyclohexyl-6-Hydroxy-3-Oxo-1-Phenyl-2,7-Dioxa-4-Aza-6-Phosphanonan-9-Oic Acid 6-Oxide (English)

InChI=1S/C24H31N4O7P/c25-23(26)27-19-13-7-12-18(14-19)20(22(29)30)35-36(32,33)21(17-10-5-2-6-11-17)28-24(31)34-15-16-8-3-1-4-9-16/h1,3-4,7-9,12-14,17,20-21H,2,5-6,10-11,15H2,(H,28,31)(H,29,30)(H,32,33)(H4,25,26,27)/t20-,21+/m0/s1

19 October 2016

Identifiers

InChI

1 reference

(5r,6r,8s)-8-(3-{[amino(Imino)methyl]amino}phenyl)-5-Cyclohexyl-6-Hydroxy-3-Oxo-1-Phenyl-2,7-Dioxa-4-Aza-6-Phosphanonan-9-Oic Acid 6-Oxide (English)

FYIHWPJXYUZMQA-LEWJYISDSA-N

19 October 2016

InChIKey

1 reference

(5r,6r,8s)-8-(3-{[amino(Imino)methyl]amino}phenyl)-5-Cyclohexyl-6-Hydroxy-3-Oxo-1-Phenyl-2,7-Dioxa-4-Aza-6-Phosphanonan-9-Oic Acid 6-Oxide (English)

19 October 2016

1 reference

(5R,8S)-8-(3-Carbamimidamidophenyl)-5-cyclohexyl-6-hydroxy-3-oxo-1-phenyl-2,7-dioxa-4-aza-6-phosphanonan-9-oic acid 6-oxide (English)

19 October 2016

2 references

(5r,6r,8s)-8-(3-{[amino(Imino)methyl]amino}phenyl)-5-Cyclohexyl-6-Hydroxy-3-Oxo-1-Phenyl-2,7-Dioxa-4-Aza-6-Phosphanonan-9-Oic Acid 6-Oxide (English)

matched by identifier from

19 October 2016

InChIKey

FYIHWPJXYUZMQA-LEWJYISDSA-N

1 reference

0 references

1 reference

2PJ4 (English)