MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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perifosine

	Properties	Image
MNX_ID	MNXM107656
reference	chebi:67272
formula	C₂₅H₅₂NO₄P
global charge	0
mol weight	461.668
InChIKey	SZFPYBIJACMNJV-UHFFFAOYSA-N
InChI	InChI=1S/C25H52NO4P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-29-31(27,28)30-25-20-22-26(2,3)23-21-25/h25H,4-24H2,1-3H3
SMILES	CCCCCCCCCCCCCCCCCCOP(=O)([O-])OC1CC[N+](C)(C)CC1

MNX internals

InChI (mnx)	InChI=1/C25H52NO4P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-29-31(27,28)30-25-20-22-26(2,3)23-21-25/h25H,4-24H2,1-3H3
SMILES (mnx)	[CH3:1][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:24][O:29][P:31](=[O:27])([O-:28])[O:30][CH:25]1[CH2:20][CH2:22][N+:26]([CH3:2])([CH3:3])[CH2:23][CH2:21]1

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
Identifier	Description
reactome:R-ALL-9616958 reactomeM:R-ALL-9616958 CHEBI:67272 chebi:67272 SZFPYBIJACMNJV-UHFFFAOYSA-N	perifosine 1,1-dimethylpiperidinium-4-yl octadecyl phosphate KRX-0401
hmdb:HMDB0256342 SZFPYBIJACMNJV-UHFFFAOYSA-N	Perifosine 1,1-dimethyl-4-{[(octadecyloxy)phosphinato]oxy}piperidin-1-ium KRX-0401 Octadecyl-(1,1-dimethyl-4-piperidylio)phosphate perifosine