(-)-BICUCULLINE METHIODIDE

CAS No.
55950-07-7
CCD No.
CCD00050006
Formula
C21 H20 N O6 . I
MolWeight
509.29

Basic Information

Product Name: (-)-BICUCULLINE METHIODIDE
CAS: 55950-07-7
English Synonyms: (5S)-5-[(6R)-6,8-DIHYDRO-8-OXOFURO[3,4-E]-1,3-BENZODIOXOL-6-YL]-5,6,7,8-TETRAHYDRO-6,6-DIMETHYL-1,3-DIOXOLO[4,5-G]ISOQUINOLINIUM IODIDE ; BICUCULLINE METHIODIDE (-)- ; 1(S),9(R)-(-)-BICUCULLINE METHIODIDE ; BICUCULLINE METHIODIDE ; [S-(R*,S*)]-5-(6,8-DIHYDRO-8-OXOFURO[3,4-E]-1,3-BENZODIOXOL-6-YL)-5,6,7,8-TETRAHYDRO-6,6-DIMETHYL-1,3-DIOXOLO[4,5-G]ISOQUINOLINIUM IODIDE ; (-)-BICUCULLINE METHIODIDE ; [R-(R,S)]-5-(6,8-DIHYDRO-8-OXOFURO[3,4-E]-1,3-BENZODIOXOL-6-YL)-5,6,7,8-TETRAHYDRO-6,6-DIMETHYL-1,3-DIOXOLO[4,5-G]ISOQUINOLINIUM IODIDE ; (5R)-5-[(6S)-6,8-DIHYDRO-8-OXOFURO[3,4-E]-1,3-BENZODIOXOL-6-YL]-5,6,7,8-TETRAHYDRO-6,6-DIMETHYL-1,3-DIOXOLO[4,5-G]ISOQUINOLINIUM IODIDE
MDL Number.: MFCD00078966
H bond acceptor: 7
H bond donor: 0
Smile: C[N+]1(CCc2cc3c(cc2[C@H]1[C@H]4c5ccc6c(c5C(=O)O4)OCO6)OCO3)C.[I-]
InChi: InChI=1S/C21H20NO6.HI/c1-22(2)6-5-11-7-15-16(26-9-25-15)8-13(11)18(22)19-12-3-4-14-20(27-10-24-14)17(12)21(23)28-19;/h3-4,7-8,18-19H,5-6,9-10H2,1-2H3;1H/q+1;/p-1/t18-,19+;/m0./s1
InChiKey: InChIKey=HKJKCPKPSSVUHY-GRTNUQQKSA-M

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WGK Germany: 3

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