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L-dihydroanticapsin

PropertiesImage
MNX_IDMNXM146287 Image of MNXM146287
referencechebi:84358
formulaC9H15NO4
global charge0
mol weight201.222
InChIKeyYMLXTGCTHGQQKS-TXXZRHAASA-N
InChIInChI=1S/C9H15NO4/c10-5(9(12)13)3-4-1-2-6(11)8-7(4)14-8/h4-8,11H,1-3,10H2,(H,12,13)/t4-,5-,6+,7+,8-/m0/s1
SMILES[NH3+][C@@H](C[C@@H]1CC[C@@H](O)[C@@H]2O[C@H]12)C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C9H15NO4/c10-5(9(12)13)3-4-1-2-6(11)8-7(4)14-8/h4-8,11H,1-3,10H2,(H,12,13)/t4-,5-,6+,7+,8-/m0/s1 Image of MNXM146287
SMILES (mnx)[CH2:1]1[CH2:2][C@@H:6]([OH:11])[C@H:8]2[C@@H:7]([C@@H:4]1[CH2:3][C@@H:5]([C:9](=[O:12])[OH:13])[NH2:10])[O:14]2
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:84358
chebi:84358
YMLXTGCTHGQQKS-TXXZRHAASA-N 		L-dihydroanticapsin
(1R,2S,5R,6S)-dihydroanticapsin zwitterion
(2S)-2-azaniumyl-3-[(1R,2S,5R,6S )-5-hydroxy-7-oxabicyclo[4.1.0]heptan-2-yl]propanoate
L-dihydroanticapsin zwitterion

seed.compound:cpd32156
seedM:cpd32156
YMLXTGCTHGQQKS-TXXZRHAASA-N 		(2S)-2-amino-3-[(1R,2S,5R,6S)-5-hydroxy-7-oxabicyclo[4.1.0]heptan-2-yl]propanoate
3-[(1R,2S,5R,6S)-5-hydroxy-7-oxabicyclo[4.1.0]hept-2-yl]-L-alanine
L-dihydroanticapsin

kegg.compound:C20940
keggC:C20940
YMLXTGCTHGQQKS-TXXZRHAASA-N 		L-Dihydroanticapsin

metacyc.compound:CPD-17531
metacycM:CPD-17531
YMLXTGCTHGQQKS-TXXZRHAASA-N 		L-dihydroanticapsin
(2S)-2-amino-3-[(1R,2S,5R,6S)-5-hydroxy-7-oxabicyclo[4.1.0]heptan-2-yl]propanoate
3-[(1R,2S,5R,6S)-5-hydroxy-7-oxabicyclo[4.1.0]hept-2-yl]-L-alanine

CHEBI:85360
chebi:85360
YMLXTGCTHGQQKS-TXXZRHAASA-N 		L-dihydroanticapsin
3-[(1R,2S,5R,6S )-5-hydroxy-7-oxabicyclo[4.1.0]heptan-2-yl]-L-alanine

keggC:M_C20940
seedM:M_cpd32156 		secondary/obsolete/fantasy identifier