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valienone 7-phosphate

PropertiesImage
MNX_IDMNXM9225 Image of MNXM9225
referencechebi:111522
formulaC7H9O8P
global charge-2
mol weight252.115
InChIKeyOIBXQBFLSXHTEZ-VQVTYTSYSA-L
InChIInChI=1S/C7H11O8P/c8-4-1-3(2-15-16(12,13)14)5(9)7(11)6(4)10/h1,5-7,9-11H,2H2,(H2,12,13,14)/p-2/t5-,6+,7+/m1/s1
SMILESO=C1C=C(COP(=O)([O-])[O-])[C@@H](O)[C@H](O)[C@H]1O
MNX internals
InChI (mnx)InChI=1/C7H11O8P/c8-4-1-3(2-15-16(12,13)14)5(9)7(11)6(4)10/h1,5-7,9-11H,2H2,(H2,12,13,14)/t5-,6+,7+/m1/s1 Image of MNXM9225
SMILES (mnx)[CH:1]1=[C:3]([CH2:2][O:15][P:16]([OH:12])([OH:13])=[O:14])[C@@H:5]([OH:9])[C@H:7]([OH:11])[C@@H:6]([OH:10])[C:4]1=[O:8]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)7
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:111522
chebi:111522
OIBXQBFLSXHTEZ-VQVTYTSYSA-L 		valienone 7-phosphate
[(4R,5S,6R)-4,5,6-trihydroxy-3-oxocyclohex-1-en-1-yl]methyl phosphate
valienone 7-phosphate(2-)

kegg.compound:C17697
keggC:C17697
OIBXQBFLSXHTEZ-VQVTYTSYSA-N 		Valienone 7-phosphate

metacyc.compound:CPD-9667
metacycM:CPD-9667
OIBXQBFLSXHTEZ-VQVTYTSYSA-L 		valienone 7-phosphate

CHEBI:131946
chebi:131946
OIBXQBFLSXHTEZ-VQVTYTSYSA-N 		valienone 7-phosphate
[(4R,5S,6R)-4,5,6-trihydroxy-3-oxocyclohex-1-en-1-yl]methyl dihydrogen phosphate

seed.compound:cpd25781
seedM:cpd25781
OIBXQBFLSXHTEZ-VQVTYTSYSA-L 		valienone-7-phosphate
valienone 7-phosphate

keggC:M_C17697
seedM:M_cpd25781 		secondary/obsolete/fantasy identifier