Catalog Number:
AG00IM1G
Chemical Name:
(1R,2S,5S)-methyl 6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxylate (2S,3S)-2,3-bis(4-methylbenzoyloxy)succinate
CAS Number:
943516-64-1
Molecular Formula:
C29H33NO10
Molecular Weight:
555.5730
MDL Number:
MFCD22125308
IUPAC Name:
(2S,3S)-2,3-bis[(4-methylbenzoyl)oxy]butanedioic acid;methyl (1R,2S,5S)-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxylate
InChI:
InChI=1S/C20H18O8.C9H15NO2/c1-11-3-7-13(8-4-11)19(25)27-15(17(21)22)16(18(23)24)28-20(26)14-9-5-12(2)6-10-14;1-9(2)5-4-10-7(6(5)9)8(11)12-3/h3-10,15-16H,1-2H3,(H,21,22)(H,23,24);5-7,10H,4H2,1-3H3/t15-,16-;5-,6-,7-/m00/s1
InChI Key:
ZCWNEOMYLIMELB-HUYFKMRMSA-N
SMILES:
OC(=O)[C@H]([C@@H](C(=O)O)OC(=O)c1ccc(cc1)C)OC(=O)c1ccc(cc1)C.COC(=O)[C@H]1NC[C@H]2[C@@H]1C2(C)C
