Chemical Component Summary

Name(3R)-3-(cyclohexylcarbonylamino)-2-oxidanyl-3,4-dihydro-1,2-benzoxaborinine-8-carboxylic acid
Identifiers(3R)-3-(cyclohexylcarbonylamino)-2-oxidanyl-3,4-dihydro-1,2-benzoxaborinine-8-carboxylic acid
FormulaC16 H20 B N O5
Molecular Weight317.145
TypeNON-POLYMER
Isomeric SMILESB1([C@H](Cc2cccc(c2O1)C(=O)O)NC(=O)C3CCCCC3)O
InChIInChI=1S/C16H20BNO5/c19-15(10-5-2-1-3-6-10)18-13-9-11-7-4-8-12(16(20)21)14(11)23-17(13)22/h4,7-8,10,13,22H,1-3,5-6,9H2,(H,18,19)(H,20,21)/t13-/m0/s1
InChIKeyZRHUJXRVIMMHFG-ZDUSSCGKSA-N

Chemical Details

Formal Charge0
Atom Count43
Chiral Atom Count1
Bond Count45
Aromatic Bond Count6

Related Resource References

Resource NameReference
PubChem 137349056