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

Feedback

(2R)-hydroxyhexadecanal

	Properties	Image
MNX_ID	MNXM35167
reference	chebi:138635
formula	C₁₆H₃₂O₂
global charge	0
mol weight	256.43
InChIKey	BKBDVQVDRVGXKT-MRXNPFEDSA-N
InChI	InChI=1S/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16(18)15-17/h15-16,18H,2-14H2,1H3/t16-/m1/s1
SMILES	CCCCCCCCCCCCCC[C@@H](O)C=O

MNX internals

InChI (mnx)	InChI=1/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16(18)15-17/h15-16,18H,2-14H2,1H3/t16-/m1/s1
SMILES (mnx)	[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][C@H:16]([CH:15]=[O:17])[OH:18]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	3

Similar chemical compounds in external resources
Identifier	Description
CHEBI:138635 chebi:138635 BKBDVQVDRVGXKT-MRXNPFEDSA-N	(2R)-hydroxyhexadecanal (2R)-2-hydroxyhexadecanal (R)-2-hydroxyhexadecanal
SLM:000598026 slm:000598026 BKBDVQVDRVGXKT-MRXNPFEDSA-N	(2R)-hydroxyhexadecanal
metacyc.compound:CPD-14766 metacycM:CPD-14766 BKBDVQVDRVGXKT-MRXNPFEDSA-N	(R)-2-hydroxyhexadecanal
bigg.metabolite:2hhxdal biggM:2hhxdal	2 Hydroxy hexadecanal
seed.compound:cpd15197 seedM:cpd15197	2-Hydroxy-hexadecanal 2hhxdal
bigg.metabolite:hhxdcal biggM:hhxdcal vmhM:hhxdcal vmhmetabolite:hhxdcal BKBDVQVDRVGXKT-UHFFFAOYSA-N	2-Hydroxyhexadecanal
seed.compound:cpd34609 seedM:cpd34609 SLM:000000369 slm:000000369 BKBDVQVDRVGXKT-MRXNPFEDSA-N BKBDVQVDRVGXKT-UHFFFAOYSA-N	2-hydroxyhexadecanal
lipidmaps:LMFA06000252 lipidmapsM:LMFA06000252 BKBDVQVDRVGXKT-UHFFFAOYSA-N	2-hydroxyhexadecanal 2-hydroxyhexadecanal FAL 16:0 O
CHEBI:50626 chebi:50626 BKBDVQVDRVGXKT-UHFFFAOYSA-N	2-hydroxyhexadecanal alpha-hydroxyhexadecanal
biggM:M_2hhxdal biggM:M_hhxdcal seedM:M_cpd15197 seedM:M_cpd34609 vmhM:M_hhxdcal	secondary/obsolete/fantasy identifier