1-linolenyl-2-linoleyl-PAP (Q27124194)

N-{2-[(9Z,12Z)-octadeca-9,12-dien-1-yloxy]-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trien-1-yloxy]propyl}aniline (English)

6 October 2016

chemical formula

C₄₅H₇₁NO₄

1 reference

N-{2-[(9Z,12Z)-octadeca-9,12-dien-1-yloxy]-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trien-1-yloxy]propyl}aniline (English)

6 October 2016

canonical SMILES

CCCCCC=CCC=CCCCCCCCC(=O)OC(CNC1=CC=CC=C1)COC(=O)CCCCCCCC=CCC=CCC=CCC

1 reference

N-{2-[(9Z,12Z)-octadeca-9,12-dien-1-yloxy]-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trien-1-yloxy]propyl}aniline (English)

6 October 2016

isomeric SMILES

CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC(CNC1=CC=CC=C1)COC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC

1 reference

N-{2-[(9Z,12Z)-octadeca-9,12-dien-1-yloxy]-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trien-1-yloxy]propyl}aniline (English)

InChI=1S/C45H71NO4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34-38-44(47)49-41-43(40-46-42-36-32-31-33-37-42)50-45(48)39-35-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11-14,17-20,31-33,36-37,43,46H,3-4,6,8-10,15-16,21-30,34-35,38-41H2,1-2H3/b7-5-,13-11-,14-12-,19-17-,20-18-

6 October 2016

Identifiers

InChI

1 reference

N-{2-[(9Z,12Z)-octadeca-9,12-dien-1-yloxy]-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trien-1-yloxy]propyl}aniline (English)

HXBZLJYQLHNONL-LOYOHVQTSA-N

6 October 2016

InChIKey

2 references

N-{2-[(9Z,12Z)-octadeca-9,12-dien-1-yloxy]-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trien-1-yloxy]propyl}aniline (English)

6 October 2016

stated in

ChEBI release 2020-09-01

1 reference

3-Anilino-2-[(9Z,12Z)-9,12-octadecadienoyloxy]propyl (9Z,12Z,15Z)-9,12,15-octadecatrienoate (English)

6 October 2016

1 reference

N-{2-[(9Z,12Z)-octadeca-9,12-dien-1-yloxy]-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trien-1-yloxy]propyl}aniline (English)

6 October 2016

ChEBI ID

53755

mapping relation type

1 reference