化学式

CAS号

IUPAC Name

(5S)-3-氯-5-甲基-1,2,4,5-四氢-3-苯并氮杂卓;(2S,3S,4S,5R)-2,3,4,5-四羟基-6-氧代己酸 (5S)-3-chloro-5-methyl-1,2,4,5-tetrahydro-3-benzazepine;(2S,3S,4S,5R)-2,3,4,5-tetrahydroxy-6-oxohexanoic acid

InChI

InChI=1S/C11H14ClN.C6H10O7/c1-9-8-13(12)7-6-10-4-2-3-5-11(9)10;7-1-2(8)3(9)4(10)5(11)6(12)13/h2-5,9H,6-8H2,1H3;1-5,8-11H,(H,12,13)/t9-;2-,3+,4-,5-/m10/s1

InChI Key

KZYGMVMXBWPIAZ-UYUXRTNJSA-N

Canonical SMILES

CC1CN(CCC2=CC=CC=C12)Cl.C(=O)C(C(C(C(C(=O)O)O)O)O)O

别名

• SCHEMBL163169