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Calystegin A3

MNXM8361 is deprecated and here replaced by MNXM740768
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM740768 Image of MNXM740768
referencechebi:3336
formulaC7H13NO3
global charge0
mol weight159.185
InChIKeyXOCBOVUINUHZJA-RKXXOXFUSA-N
InChIInChI=1S/C7H13NO3/c9-5-3-4-1-2-7(11,8-4)6(5)10/h4-6,8-11H,1-3H2/t4?,5-,6-,7?/m1/s1
SMILESO[C@@H]1CC2CCC(O)(N2)[C@@H]1O
MNX internals
InChI (mnx)InChI=1/C7H13NO3/c9-5-3-4-1-2-7(11,8-4)6(5)10/h4-6,8-11H,1-3H2/t4?,5-,6-,7?/m1/s1 Image of MNXM740768
SMILES (mnx)[CH2:1]1[CH2:2][C:7]2([OH:11])[C@H:6]([OH:10])[C@H:5]([OH:9])[CH2:3][CH:4]1[NH:8]2
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
IdentifierDescription

CHEBI:3336
chebi:3336
kegg.compound:C10850
keggC:C10850
XOCBOVUINUHZJA-RKXXOXFUSA-N 		Calystegin A3
Calystegine A3

seed.compound:cpd07736
seedM:cpd07736
XOCBOVUINUHZJA-RKXXOXFUSA-O 		Calystegin A3
Calystegine A3
calystegine A3

keggC:M_C10850
seedM:M_cpd07736 		secondary/obsolete/fantasy identifier