71219383 -OEChem-05112415572D 62 65 0 1 0 0 0 0 0999 V2000 2.0000 -1.7805 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 13.5482 2.8386 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 -3.8046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7622 -0.2065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8962 -4.1706 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8962 -2.4386 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 -0.8046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7743 3.8627 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8962 -2.4386 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 -3.3046 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.8962 -0.7065 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3962 -3.3046 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3961 -2.3046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3962 -1.5726 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.0301 -0.2065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8962 -2.4386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 -1.8046 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.3962 -1.5726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0301 0.7935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8962 -4.1706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3962 -1.5726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6641 -2.3046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6641 -3.3046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8962 1.2935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7622 0.7935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 -1.7700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 -3.8393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8801 2.3350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6722 1.3003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 -2.2838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 -3.3254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7781 2.8627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6802 2.3419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0162 -3.3046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0067 -2.4123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6082 -1.7220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0862 -2.1095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4195 -0.0989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8181 -0.7892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0038 -1.8280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3135 -2.2265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0671 -1.4946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5038 -0.9620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8135 -1.3605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8181 1.3761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4195 0.6858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3592 -4.4806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2062 -4.7076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4331 -3.8606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8592 -1.8826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7062 -2.1095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9331 -1.2626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2061 -2.9755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5162 -4.1706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5162 -2.4386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7773 -1.1500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7773 -4.4592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3396 2.6387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0671 -0.4946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2055 0.9841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3284 -3.6375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2361 4.1706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 30 1 0 0 0 0 2 33 1 0 0 0 0 3 10 1 0 0 0 0 3 23 1 0 0 0 0 4 11 1 0 0 0 0 4 25 1 0 0 0 0 12 5 1 6 0 0 0 5 54 1 0 0 0 0 14 6 1 1 0 0 0 6 55 1 0 0 0 0 17 7 1 6 0 0 0 7 59 1 0 0 0 0 8 32 1 0 0 0 0 8 62 1 0 0 0 0 9 16 1 0 0 0 0 9 18 1 0 0 0 0 9 53 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 10 20 1 6 0 0 0 11 14 1 0 0 0 0 11 15 1 0 0 0 0 11 21 1 6 0 0 0 12 16 1 0 0 0 0 12 34 1 0 0 0 0 13 17 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 18 1 0 0 0 0 14 37 1 0 0 0 0 15 19 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 22 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 24 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 28 2 0 0 0 0 25 29 2 0 0 0 0 26 30 2 0 0 0 0 26 56 1 0 0 0 0 27 31 2 0 0 0 0 27 57 1 0 0 0 0 28 32 1 0 0 0 0 28 58 1 0 0 0 0 29 33 1 0 0 0 0 29 60 1 0 0 0 0 30 31 1 0 0 0 0 31 61 1 0 0 0 0 32 33 2 0 0 0 0 M END > 71219383 > 1 > 675 > 9 > 5 > 6 > AAADceB6OYAAAAAAAAAAAAAAAAAAAAAAAAA0aIEAAAAAAACRQAAAHwAQCAAADFThmA4yBoLABgCAAiBCAAACCAAgIAAIiIAOCIgPNyKGsRqGeCCn0BGbuAfQ0PIOAQABAAAIAAACAAIAABAAAAAAAAAAAA== > (2R)-7-fluoro-2-[(1S)-2-[[(2S)-2-[(2S,4R)-6-fluoro-4-hydroxy-2-methyl-chroman-2-yl]-2-hydroxy-ethyl]amino]-1-hydroxy-ethyl]-2-methyl-chroman-6-ol > (2R)-7-fluoro-2-[(1S)-2-[[(2S)-2-[(2S,4R)-6-fluoro-4-hydroxy-2-methyl-3,4-dihydro-2H-1-benzopyran-2-yl]-2-hydroxyethyl]amino]-1-hydroxyethyl]-2-methyl-3,4-dihydro-2H-1-benzopyran-6-ol > (2R)-7-fluoro-2-[(1S)-2-[[(2S)-2-[(2S,4R)-6-fluoro-4-hydroxy-2-methyl-3,4-dihydrochromen-2-yl]-2-hydroxyethyl]amino]-1-hydroxyethyl]-2-methyl-3,4-dihydrochromen-6-ol > (2R)-7-fluoro-2-[(1S)-2-[[(2S)-2-[(2S,4R)-6-fluoro-4-hydroxy-2-methyl-3,4-dihydrochromen-2-yl]-2-hydroxyethyl]amino]-1-hydroxyethyl]-2-methyl-3,4-dihydrochromen-6-ol > (2R)-7-fluoranyl-2-[(1S)-2-[[(2S)-2-[(2S,4R)-6-fluoranyl-2-methyl-4-oxidanyl-3,4-dihydrochromen-2-yl]-2-oxidanyl-ethyl]amino]-1-oxidanyl-ethyl]-2-methyl-3,4-dihydrochromen-6-ol > (2R)-7-fluoro-2-[(1S)-2-[[(2S)-2-[(2S,4R)-6-fluoro-4-hydroxy-2-methyl-chroman-2-yl]-2-hydroxy-ethyl]amino]-1-hydroxy-ethyl]-2-methyl-chroman-6-ol > InChI=1S/C24H29F2NO6/c1-23(6-5-13-7-17(28)16(26)9-20(13)33-23)21(30)11-27-12-22(31)24(2)10-18(29)15-8-14(25)3-4-19(15)32-24/h3-4,7-9,18,21-22,27-31H,5-6,10-12H2,1-2H3/t18-,21+,22+,23-,24+/m1/s1 > NQCFKNXZDGLMAE-XNQICQOHSA-N > 1.9 > 465.19629397 > C24H29F2NO6 > 465.5 > CC1(CCC2=CC(=C(C=C2O1)F)O)C(CNCC(C3(CC(C4=C(O3)C=CC(=C4)F)O)C)O)O > C[C@@]1(CCC2=CC(=C(C=C2O1)F)O)[C@H](CNC[C@@H]([C@@]3(C[C@H](C4=C(O3)C=CC(=C4)F)O)C)O)O > 111 > 465.19629397 > 0 > 33 > 5 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 20 6 11 21 6 22 23 8 22 26 8 23 27 8 24 25 8 24 28 8 25 29 8 26 30 8 27 31 8 28 32 8 29 33 8 30 31 8 32 33 8 12 5 6 14 6 5 17 7 6 $$$$