3494 -OEChem-09121811093D 51 53 0 1 0 0 0 0 0999 V2000 -0.7238 -0.5647 -0.3774 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0389 -0.2703 1.9051 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4806 -1.1301 1.8436 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3255 -0.1773 0.0419 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.8965 -0.1642 0.6228 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0707 -0.9960 -0.3427 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.2093 -0.8413 -1.3443 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1468 -1.1546 -0.2892 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7369 -0.7498 -1.6799 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4089 -0.1901 0.6226 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6425 -0.8690 -0.3828 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1215 -2.5950 0.2122 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2338 -2.1635 -0.9323 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2487 -3.2729 -0.5596 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2629 -0.9753 0.9333 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8519 1.2443 -0.0935 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0265 -0.6855 0.7962 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4346 1.2754 0.2091 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4733 2.2440 1.1904 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 1.5888 -1.1342 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4964 3.5863 0.8116 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4412 2.9310 -1.5131 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4803 3.9297 -0.5401 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9265 -0.5761 1.6363 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5502 0.8749 0.6742 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1181 -2.0638 -0.0913 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8579 -0.3240 -2.0577 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5243 -1.8864 -1.2471 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7196 -1.1612 -1.3009 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4339 -1.4821 -2.4346 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4787 0.2417 -2.0718 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0867 -0.6642 0.5983 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8756 -0.0213 -1.0342 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1628 -3.0906 0.0284 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3409 -2.6818 1.2812 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2313 -2.3510 -0.5221 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3329 -2.1065 -2.0224 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8586 -3.7426 -1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7258 -4.0583 0.0353 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8530 -1.9823 1.0558 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3306 -0.4710 1.9018 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2439 -1.0158 0.4508 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1897 1.7980 -0.7656 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8642 1.1997 -0.5061 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8626 1.7025 0.8999 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7552 -1.0839 2.3533 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4675 2.0102 2.2503 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 0.8409 -1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 4.3644 1.5689 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 3.1990 -2.5655 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4961 4.9749 -0.8351 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 17 1 0 0 0 0 2 10 1 0 0 0 0 2 46 1 0 0 0 0 3 17 2 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 15 1 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 6 9 1 0 0 0 0 6 26 1 0 0 0 0 7 9 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 8 29 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 17 1 0 0 0 0 10 18 1 0 0 0 0 11 13 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 14 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 19 47 1 0 0 0 0 20 22 2 0 0 0 0 20 48 1 0 0 0 0 21 23 2 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 23 51 1 0 0 0 0 M CHG 1 4 1 M END > DB00986 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/ANGKOCUUWGHLCE-UHFFFAOYSA-N/SDF?record_type=3d > C[N+]1(C)CCC(C1)OC(=O)C(O)(C1CCCC1)C1=CC=CC=C1 > InChI=1S/C19H28NO3/c1-20(2)13-12-17(14-20)23-18(21)19(22,16-10-6-7-11-16)15-8-4-3-5-9-15/h3-5,8-9,16-17,22H,6-7,10-14H2,1-2H3/q+1 > ANGKOCUUWGHLCE-UHFFFAOYSA-N > C19H28NO3 > 318.4305 > 318.206918767 > 2 > 51 > 35.8812187933965 > 1 > 1 > 1 > 0 > 3-[(2-cyclopentyl-2-hydroxy-2-phenylacetyl)oxy]-1,1-dimethylpyrrolidin-1-ium > -1.20 > -1.4080879931384127 > -5.57 > 0 > 3 > 1 > 11.533272276219833 > -4.315146706381445 > 46.53 > 101.0809 > 5 > 1 > 9.44e-04 g/l > glycopyrrolate > 0 $$$$