646 Mrv0541 02231214512D 65 66 0 0 1 0 999 V2000 4.9509 3.3001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2365 2.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8075 2.8876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2365 5.3626 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0944 2.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3832 1.1878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2379 -4.1251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7925 -0.9356 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6655 -2.8876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5234 -2.8876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6175 1.5395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6668 -1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0944 -5.3626 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6175 0.1106 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2365 -1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3814 -2.8876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9524 -5.3626 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8075 4.5376 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 4.1251 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5220 3.3001 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2365 4.5376 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2365 2.8876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9509 4.1251 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9509 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6655 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3799 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3799 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6655 4.5376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6655 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6655 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9509 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3799 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6655 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0944 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8089 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5234 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9509 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8089 -4.1251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2379 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2050 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9509 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9524 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0944 -4.5376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5234 -4.5376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9524 -2.8876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3799 -4.1251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6668 -3.3001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8089 -3.3001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2365 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6668 -4.1251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5234 -5.3626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3799 -3.3001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9524 -4.5376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6655 -4.5376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2365 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9509 -4.1251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2365 -4.5376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 -4.1251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8075 -4.5376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8075 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 -4.1251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8075 -2.8876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 -3.3001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 22 1 0 0 0 0 2 24 1 0 0 0 0 20 3 1 1 0 0 0 21 4 1 6 0 0 0 5 26 1 0 0 0 0 6 29 1 0 0 0 0 7 44 1 0 0 0 0 7 53 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 10 36 1 0 0 0 0 11 40 1 0 0 0 0 12 42 1 0 0 0 0 13 43 1 0 0 0 0 14 40 2 0 0 0 0 15 41 2 0 0 0 0 16 47 1 0 0 0 0 17 53 2 0 0 0 0 19 18 1 1 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 23 28 1 1 0 0 0 24 25 1 0 0 0 0 24 31 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 29 1 0 0 0 0 27 40 1 0 0 0 0 29 30 1 0 0 0 0 30 41 1 0 0 0 0 31 49 2 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 33 37 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 39 1 0 0 0 0 37 41 1 0 0 0 0 38 43 1 0 0 0 0 38 44 1 0 0 0 0 38 48 1 0 0 0 0 39 42 1 0 0 0 0 42 45 1 0 0 0 0 43 46 1 0 0 0 0 44 51 1 0 0 0 0 45 47 1 0 0 0 0 46 52 1 0 0 0 0 46 54 1 0 0 0 0 47 50 1 0 0 0 0 49 55 1 0 0 0 0 50 53 1 0 0 0 0 54 56 2 0 0 0 0 55 57 2 0 0 0 0 56 58 1 0 0 0 0 57 59 1 0 0 0 0 58 60 2 0 0 0 0 59 62 2 0 0 0 0 60 61 1 0 0 0 0 61 63 1 0 0 0 0 62 64 1 0 0 0 0 63 65 1 0 0 0 0 64 65 2 0 0 0 0 M END > DB00646 > drugbank > C[C@H]1OC(OC2CC(O)C(C(O)CC(=O)CC(O)C(O)CCC(O)CC(O)CC(O)CC(=O)OC(C)C(C)C(O)C(C)\C=C\C=C\CC\C=C\C=C\C=C\C=C\2)C(O)=O)[C@@H](O)[C@@H](N)[C@@H]1O > InChI=1S/C47H75NO17/c1-27-17-15-13-11-9-7-5-6-8-10-12-14-16-18-35(65-47-45(60)42(48)44(59)30(4)64-47)26-39(56)41(46(61)62)38(55)24-34(52)23-37(54)36(53)20-19-31(49)21-32(50)22-33(51)25-40(57)63-29(3)28(2)43(27)58/h5-6,8,10-18,27-33,35-39,41-45,47,49-51,53-56,58-60H,7,9,19-26,48H2,1-4H3,(H,61,62)/b6-5+,10-8+,13-11+,14-12+,17-15+,18-16+/t27?,28?,29?,30-,31?,32?,33?,35?,36?,37?,38?,39?,41?,42+,43?,44-,45+,47?/m1/s1 > InChIKey=ZDFDJJJGIRGMBE-AFARJNEBSA-N > 17 > 102.10814694575765 > 0 > 12 > 925.503499979 > 0 > C47H75NO17 > 0 > (21E,23E,25E,27E,31E,33E)-20-{[(3S,4S,5S,6R)-4-amino-3,5-dihydroxy-6-methyloxan-2-yl]oxy}-4,6,8,11,12,16,18,36-octahydroxy-35,37,38-trimethyl-2,14-dioxo-1-oxacyclooctatriaconta-21,23,25,27,31,33-hexaene-17-carboxylic acid > -2.82 > -2.666154540022299 > -4.15 > 926.0949 > 0 > 2 > 0 > 12.651951568418127 > 3.6208467022216593 > 9.11381640698386 > 327.44999999999993 > 245.17500000000004 > 3 > 0 > 6.60e-02 g/l > nystatin > 0 > DB00646 > approved > Nystatin > Nistatina; Nystatin; Nystatine; Nystatinum > Adiclair; Afunginal; Biofanal; Candacide; Candermil; Candex; Candidias; Candistat; Candistin; Canstat; Cazetin; Diaper NZ; Dipni; Enystin; Fukangning; Fungatin; Fungicidin Leciva; Fungistin; Fungostatin; Funistatin; Gynostatin; Kandistatin; Kenalon; Lederlind; Ledernyst; Lystin; Mycostatin; Nilstat; Nyaderm; Nyamyc; Nystan; Nystop; Pedi-Dri > Nystatin dihydrate $$$$