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

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Fusarin C

MNXM54069 is deprecated and here replaced by MNXM737950
!!! Alternative mappings exist !!!

	Properties	Image
MNX_ID	MNXM737950
reference	chebi:82329
formula	C₂₃H₂₉NO₇
global charge	0
mol weight	431.485
InChIKey	FZFYFSUIOSWLHW-UNZVFGKVSA-N
InChI	InChI=1S/C23H29NO7/c1-6-17(19(27)30-5)13-15(3)12-14(2)8-7-9-16(4)18(26)23-20(31-23)22(29,10-11-25)24-21(23)28/h6-9,12-13,20,25,29H,10-11H2,1-5H3,(H,24,28)/b8-7+,14-12+,15-13+,16-9+,17-6+/t20-,22-,23-/m0/s1
SMILES	C/C=C(\C=C(C)\C=C(C)\C=C\C=C(/C)C(=O)[C@]12O[C@H]1[C@@](O)(CCO)NC2=O)C(=O)OC

MNX internals

InChI (mnx)	InChI=1/C23H29NO7/c1-6-17(19(27)30-5)13-15(3)12-14(2)8-7-9-16(4)18(26)23-20(31-23)22(29,10-11-25)24-21(23)28/h6-9,12-13,20,25,29H,10-11H2,1-5H3,(H,24,28)/b8-7+,14-12+,15-13+,16-9+,17-6+/t20-,22-,23-/m0/s1
SMILES (mnx)	[CH3:1]/[CH:6]=[C:17](\[CH:13]=[C:15]([CH3:3])\[CH:12]=[C:14]([CH3:2])\[CH:8]=[CH:7]\[CH:9]=[C:16](/[CH3:4])[C:18]([C@:23]12[C@H:20]([C@:22]([CH2:10][CH2:11][OH:25])([OH:29])[N:24]=[C:21]1[OH:28])[O:31]2)=[O:26])[C:19](=[O:27])[O:30][CH3:5]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:82329 chebi:82329 kegg.compound:C19243 keggC:C19243 FZFYFSUIOSWLHW-UNZVFGKVSA-N	Fusarin C
seed.compound:cpd20501 seedM:cpd20501 FZFYFSUIOSWLHW-UNZVFGKVSA-N	Fusarin C fusarin C
metacyc.compound:CPD-18054 metacycM:CPD-18054 FZFYFSUIOSWLHW-UNZVFGKVSA-N	fusarin C
keggC:M_C19243 seedM:M_cpd20501	secondary/obsolete/fantasy identifier