3-Hydroxy-5, 8-tetradecadiencarnitine (Q27161936)

3-Hydroxy-5, 8-tetradecadiencarnitine (English)

9 October 2016

chemical formula

C₂₁H₃₇NO₅

1 reference

3-Hydroxy-5, 8-tetradecadiencarnitine (English)

9 October 2016

canonical SMILES

CCCCCCC=CC=CCC(CC(=O)OC(CCC(=O)[O-])[N+](C)(C)C)O

1 reference

3-Hydroxy-5, 8-tetradecadiencarnitine (English)

9 October 2016

isomeric SMILES

CCCCCC/C=C/C=C/CC(CC(=O)O[C@@H](CCC(=O)[O-])[N+](C)(C)C)O

1 reference

3-Hydroxy-5, 8-tetradecadiencarnitine (English)

InChI=1S/C21H37NO5/c1-5-6-7-8-9-10-11-12-13-14-18(23)17-21(26)27-19(22(2,3)4)15-16-20(24)25/h10-13,18-19,23H,5-9,14-17H2,1-4H3/b11-10+,13-12+/t18?,19-/m0/s1

9 October 2016

Identifiers

InChI

1 reference

3-Hydroxy-5, 8-tetradecadiencarnitine (English)

YLCGQCCCWXNFOA-YAAUQWKMSA-N

9 October 2016

InChIKey

2 references

3-Hydroxy-5, 8-tetradecadiencarnitine (English)

9 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(4S)-4-{[(5E,7E)-3-Hydroxy-5,7-tetradecadienoyl]oxy}-4-(trimethylammonio)butanoate (English)

9 October 2016

2 references

3-Hydroxy-5, 8-tetradecadiencarnitine (English)

matched by identifier from

9 October 2016

InChIKey

YLCGQCCCWXNFOA-YAAUQWKMSA-N

ChEBI ID

89747

mapping relation type

2 references

3-Hydroxy-5, 8-tetradecadiencarnitine (English)