Search MNXref
 Feedback

1-(11E-octadecenoyl)-2-octanoyl-sn-glycero-3-phosphate

PropertiesImage
MNX_IDMNXM192769 Image of MNXM192769
referenceslm:000021086
formulaC29H53O8P
global charge-2
mol weight560.709
InChIKeyAKWUAHUXJWMIIZ-ZPIZUECNSA-L
InChIInChI=1S/C29H55O8P/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-20-21-23-28(30)35-25-27(26-36-38(32,33)34)37-29(31)24-22-19-8-6-4-2/h11-12,27H,3-10,13-26H2,1-2H3,(H2,32,33,34)/p-2/b12-11+/t27-/m1/s1
SMILESCCCCCC/C=C/CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])[O-])OC(=O)CCCCCCC
MNX internals
InChI (mnx)InChI=1/C29H55O8P/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-20-21-23-28(30)35-25-27(26-36-38(32,33)34)37-29(31)24-22-19-8-6-4-2/h11-12,27H,3-10,13-26H2,1-2H3,(H2,32,33,34)/b12-11+/t27-/m1/s1 Image of MNXM192769
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:10]/[CH:11]=[CH:12]/[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:20][CH2:21][CH2:23][C:28](=[O:30])[O:35][CH2:25][C@H:27]([CH2:26][O:36][P:38]([OH:32])([OH:33])=[O:34])[O:37][C:29]([CH2:24][CH2:22][CH2:19][CH2:8][CH2:6][CH2:4][CH3:2])=[O:31]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

SLM:000021086
slm:000021086
AKWUAHUXJWMIIZ-ZPIZUECNSA-L
1-(11E-octadecenoyl)-2-octanoyl-sn-glycero-3-phosphate
PA(18:1(11E)/8:0)
Phosphatidate (18:1(11E)/8:0)