(Q27108681)

inferred from isomeric SMILES

1 February 2021

mass

296.05517380973 dalton

1 reference

based on heuristic

chemical formula

C₉H₁₅NO₈P³⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CC(C)(COP(=O)([O-])[O-])C(C(=O)NCCC(=O)[O-])O

1 reference

(R)-4'-phosphopantothenate (English)

5 October 2016

isomeric SMILES

CC(C)(COP(=O)([O-])[O-])[C@H](C(=O)NCCC(=O)[O-])O

1 reference

https://reactome.org/PathwayBrowser/#/R-HSA-1430728&DTAB=MT

(R)-4'-phosphopantothenate (English)

5 October 2016

1 reference

Identifiers

InChI

InChI=1S/C9H18NO8P/c1-9(2,5-18-19(15,16)17)7(13)8(14)10-4-3-6(11)12/h7,13H,3-5H2,1-2H3,(H,10,14)(H,11,12)(H2,15,16,17)/p-3/t7-/m0/s1

1 reference

(R)-4'-phosphopantothenate (English)

XHFVGHPGDLDEQO-ZETCQYMHSA-K

5 October 2016

InChIKey

2 references

(R)-4'-phosphopantothenate (English)

5 October 2016

stated in

ChEBI release 2020-09-01

1 reference

3-{[(2R)-2-Hydroxy-3,3-dimethyl-4-(phosphonatooxy)butanoyl]amino}propanoate (English)

5 October 2016

2 references

(R)-4'-phosphopantothenate (English)

matched by identifier from

5 October 2016

InChIKey

XHFVGHPGDLDEQO-ZETCQYMHSA-K

102590471

1 reference

matched by identifier from

InChIKey

XHFVGHPGDLDEQO-ZETCQYMHSA-K

ChEBI ID

10986

mapping relation type

2 references

(R)-4'-phosphonatopantothenate(3-) (English)