Mrv0541 04291417362D 23 25 0 0 0 0 999 V2000 14.9569 -13.2874 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 12.8135 -15.3499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2424 -15.3499 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5279 -15.7624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8135 -14.5249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9569 -14.1124 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.2424 -14.5249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0990 -14.1124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2424 -12.8749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6713 -12.8749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0990 -15.7624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5279 -16.5874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6713 -14.5249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0990 -13.2874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3845 -14.5249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2424 -12.0499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6713 -12.0499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0990 -16.5874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8135 -16.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6700 -14.1124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3845 -12.8749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6700 -13.2874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9569 -11.6374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6 1 1 0 0 0 0 9 1 1 0 0 0 0 10 1 1 0 0 0 0 4 2 2 0 0 0 0 5 2 1 0 0 0 0 11 2 1 0 0 0 0 7 3 1 0 0 0 0 4 3 1 0 0 0 0 12 4 1 0 0 0 0 8 5 1 0 0 0 0 7 6 1 0 0 0 0 6 13 1 6 0 0 0 14 8 1 0 0 0 0 15 8 2 0 0 0 0 16 9 1 0 0 0 0 17 10 1 0 0 0 0 18 11 2 0 0 0 0 19 12 2 0 0 0 0 21 14 2 0 0 0 0 20 15 1 0 0 0 0 23 16 1 0 0 0 0 23 17 1 0 0 0 0 19 18 1 0 0 0 0 22 20 2 0 0 0 0 22 21 1 0 0 0 0 M CHG 1 1 1 M END > CHEBI:78391 > (R)-benproperine(1+) > An ammonium ion resulting from the protonation of the nitrogen of (R)-benproperine. > 3 > 1-[(2R)-1-(2-benzylphenoxy)propan-2-yl]piperidinium > C21H28NO > 310.45260 > 310.21654 > 1 > C[C@H](COc1ccccc1Cc1ccccc1)[NH+]1CCCCC1 > InChI=1S/C21H27NO/c1-18(22-14-8-3-9-15-22)17-23-21-13-7-6-12-20(21)16-19-10-4-2-5-11-19/h2,4-7,10-13,18H,3,8-9,14-17H2,1H3/p+1/t18-/m1/s1 > JTUQXGZRVLWBCR-GOSISDBHSA-O $$$$