Mrv1652309122217172D 29 31 0 0 1 0 999 V2000 -2.1828 -4.2662 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8472 -3.5126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0267 -3.4263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5418 -4.0938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2787 -4.0075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6142 -3.2538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1293 -2.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6912 -2.6726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1761 -2.0052 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8406 -1.2515 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3255 -0.5841 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9899 0.1696 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4748 0.8370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1393 1.5907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6242 2.2581 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4492 2.2581 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7041 3.0428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0367 3.5277 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.5887 4.1408 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4847 4.1408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7396 4.9254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3693 3.0428 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5846 3.2977 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1694 0.2558 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1661 1.0095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3155 -0.4116 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1360 -0.3254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0201 -1.1653 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4648 -1.8327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 3 8 1 0 0 0 0 8 9 1 0 0 0 0 10 9 1 6 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 6 0 0 0 13 14 1 0 0 0 0 15 14 1 6 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 1 0 0 0 18 20 1 6 0 0 0 20 21 1 0 0 0 0 18 22 1 0 0 0 0 15 22 1 0 0 0 0 22 23 1 1 0 0 0 12 24 1 0 0 0 0 24 25 1 1 0 0 0 24 26 1 0 0 0 0 26 27 1 6 0 0 0 26 28 1 0 0 0 0 10 28 1 0 0 0 0 28 29 1 1 0 0 0 M END > NP0330185 > NP-MRD > OCC1=CC=CC=C1O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O > InChI=1S/C18H26O11/c19-5-9-3-1-2-4-10(9)28-16-14(23)13(22)12(21)11(29-16)6-26-17-15(24)18(25,7-20)8-27-17/h1-4,11-17,19-25H,5-8H2/t11-,12-,13+,14-,15+,16-,17-,18-/m1/s1 > LREJRSFSOHVXFP-FQXXIRCGSA-N > C18H26O11 > 418.395 > 418.147511657 > 11 > 55 > 39.89122508080972 > 0 > 7 > 0 > 0 > (2R,3S,4S,5R,6S)-2-({[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-[2-(hydroxymethyl)phenoxy]oxane-3,4,5-triol > -2.6422364263333336 > 1 > 3 > 0 > 12.310337979400668 > 11.70128604378318 > -2.936096592275419 > 178.53 > 93.66940000000004 > 7 > 0 > (2R,3S,4S,5R,6S)-2-({[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-[2-(hydroxymethyl)phenoxy]oxane-3,4,5-triol > 0 > NP0330185 > (2r,3s,4s,5r,6s)-2-({[(2r,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-[2-(hydroxymethyl)phenoxy]oxane-3,4,5-triol $$$$