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

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17-Oxosparteine

MNXM6650 is deprecated and here replaced by MNXM739329
!!! Alternative mappings exist !!!

	Properties	Image
MNX_ID	MNXM739329
reference	chebi:81549
formula	C₁₅H₂₄N₂O
global charge	0
mol weight	248.37
InChIKey	YQMWQSMYVPLYDI-RFQIPJPRSA-N
InChI	InChI=1S/C15H24N2O/c18-15-12-9-11(13-5-2-4-8-17(13)15)10-16-7-3-1-6-14(12)16/h11-14H,1-10H2/t11-,12+,13-,14+/m0/s1
SMILES	O=C1[C@@H]2C[C@@H](CN3CCCC[C@H]23)[C@@H]2CCCCN12

MNX internals

InChI (mnx)	InChI=1/C15H24N2O/c18-15-12-9-11(13-5-2-4-8-17(13)15)10-16-7-3-1-6-14(12)16/h11-14H,1-10H2/t11-,12+,13-,14+/m0/s1
SMILES (mnx)	[CH2:1]1[CH2:3][CH2:7][N:16]2[CH2:10][C@@H:11]3[CH2:9][C@H:12]([C@H:14]2[CH2:6]1)[C:15](=[O:18])[N:17]1[CH2:8][CH2:4][CH2:2][CH2:5][C@@H:13]31

Parent-child relations graph

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

Similar chemical compounds in external resources
Identifier	Description
seed.compound:cpd19428 seedM:cpd19428 CHEBI:81549 chebi:81549 kegg.compound:C18158 keggC:C18158 YQMWQSMYVPLYDI-CLRIEMFWSA-O YQMWQSMYVPLYDI-RFQIPJPRSA-N	17-Oxosparteine
keggC:M_C18158 seedM:M_cpd19428	secondary/obsolete/fantasy identifier