Marvin 04211010452D 26 29 0 0 0 0 999 V2000 5.0933 -5.5515 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1822 -6.3701 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6597 -5.9352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6662 -5.9352 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5215 -5.1055 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9596 -5.5696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1353 -6.6591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7670 -6.2764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8697 -7.5363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1602 -7.1609 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8600 -5.7119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5023 -4.8311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5685 -7.0977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9002 -8.3608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2970 -7.4867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9953 -7.0487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9654 -6.2233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2310 -5.8378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5357 -6.2780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2018 -8.7962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2319 -9.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9618 -10.0067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6628 -9.5635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6293 -8.7413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0968 -4.3980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8967 -5.9576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 6 0 0 0 9 13 1 0 0 0 0 4 5 1 0 0 0 0 9 14 1 0 0 0 0 5 1 1 0 0 0 0 13 15 2 0 0 0 0 1 6 1 0 0 0 0 15 16 1 0 0 0 0 6 2 1 0 0 0 0 16 17 2 0 0 0 0 4 7 1 0 0 0 0 17 18 1 0 0 0 0 1 8 1 0 0 0 0 18 19 2 0 0 0 0 19 13 1 0 0 0 0 7 8 1 0 0 0 0 14 20 2 0 0 0 0 10 9 1 0 0 0 0 20 21 1 0 0 0 0 2 3 1 0 0 0 0 21 22 2 0 0 0 0 2 10 1 0 0 0 0 22 23 1 0 0 0 0 3 4 1 0 0 0 0 23 24 2 0 0 0 0 24 14 1 0 0 0 0 4 11 1 1 0 0 0 5 25 1 0 0 0 0 2 26 1 1 0 0 0 M END > CHEBI:3048 > benzatropine > Tropane in which a hydrogen at position 3 is substituted by a diphenylmethoxy group (endo-isomer). An acetylcholine receptor antagonist, it is used (particularly as its methanesulphonate salt) in the treatment of Parkinson's disease, and to reduce parkinsonism and akathisia side effects of antipsychotic treatments. > 3 > CHEBI:661238 > tropine benzohydryl ether; Benztropine; benzhydryl 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ether; Benzatropine; 3endo-benzhydryloxytropane; 3alpha-benzhydryloxy-8-methyl-8-azabicyclo[3.2.1]octane; 3alpha-(diphenylmethoxy)tropane; 3alpha-(diphenylmethoxy)-1alphaH,5alphaH-tropane > (3-endo)-3-(diphenylmethoxy)-8-methyl-8-azabicyclo[3.2.1]octane > benzatropinum; benzatropine; benzatropina > C21H25NO > 307.42930 > 307.19361 > 0 > [H][C@]1(C[C@]2([H])CC[C@]([H])(C1)N2C)OC(c1ccccc1)c1ccccc1 > InChI=1S/C21H25NO/c1-22-18-12-13-19(22)15-20(14-18)23-21(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,18-21H,12-15H2,1H3/t18-,19+,20+ > GIJXKZJWITVLHI-PMOLBWCYSA-N > 90688 > 86-13-5 > 86-13-5 > DB00245 > C06846 > D07511 > 86-13-5 > Benzatropine $$$$