N-acetylneuraminic acid 9-phosphate (Q27103128)

N-acetylneuraminic acid 9-phosphate (English)

5 October 2016

chemical formula

C₁₁H₂₀NO₁₂P

1 reference

N-acetylneuraminic acid 9-phosphate (English)

5 October 2016

canonical SMILES

CC(=O)NC1C(CC(OC1C(C(COP(=O)(O)O)O)O)(C(=O)O)O)O

1 reference

N-acetylneuraminic acid 9-phosphate (English)

5 October 2016

isomeric SMILES

CC(=O)N[C@@H]1[C@H](CC(O[C@H]1[C@@H]([C@@H](COP(=O)(O)O)O)O)(C(=O)O)O)O

1 reference

Recon 2.2: from reconstruction to model of human metabolism

N-acetylneuraminic acid 9-phosphate (English)

5 October 2016

2 references

stated in

A community-driven global reconstruction of human metabolism.

Identifiers

InChI

InChI=1S/C11H20NO12P/c1-4(13)12-7-5(14)2-11(19,10(17)18)24-9(7)8(16)6(15)3-23-25(20,21)22/h5-9,14-16,19H,2-3H2,1H3,(H,12,13)(H,17,18)(H2,20,21,22)/t5-,6+,7+,8+,9+,11?/m0/s1

1 reference

N-acetylneuraminic acid 9-phosphate (English)

SQMNIXJSBCSNCI-LUWBGTNYSA-N

5 October 2016

InChIKey

2 references

N-acetylneuraminic acid 9-phosphate (English)

5 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(6R)-5-Acetamido-3,5-dideoxy-6-[(2R)-1,2-dihydroxy-3-(phosphonooxy)propyl]-L-threo-hex-2-ulopyranosonic acid (English)

5 October 2016

1 reference

N-acetylneuraminic acid 9-phosphate (English)

5 October 2016

ChEBI ID

27438

mapping relation type

2 references

N-acetylneuraminic acid 9-phosphate (English)