Mrv1652309072214122D 14 16 0 0 1 0 999 V2000 0.3220 -1.1901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5182 -0.3888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0776 0.1818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1186 0.9831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9107 1.2138 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1070 2.0151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5066 0.6432 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3293 0.7042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1467 0.5928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6415 -0.0595 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0118 -0.5924 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0727 -1.4151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3103 -0.1581 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1989 -0.9756 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 1 0 0 0 5 7 1 0 0 0 0 7 8 1 6 0 0 0 8 9 1 1 0 0 0 10 9 1 1 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 1 0 0 0 11 13 1 0 0 0 0 2 13 1 0 0 0 0 7 13 1 0 0 0 0 13 14 1 1 0 0 0 M END > NP0249598 > NP-MRD > CC1=CO[C@@H](O)[C@@H]2[C@H]3O[C@H]3[C@@H](O)[C@]12O > InChI=1S/C9H12O5/c1-3-2-13-8(11)4-5-6(14-5)7(10)9(3,4)12/h2,4-8,10-12H,1H3/t4-,5+,6+,7+,8+,9-/m0/s1 > BEPSPJNQDRJMRF-ZLFMKPOPSA-N > C9H12O5 > 200.19 > 200.068473486 > 5 > 26 > 18.354108964974543 > 1 > 3 > 0 > 0 > (1R,2R,4S,5R,6R,10R)-7-methyl-3,9-dioxatricyclo[4.4.0.0^{2,4}]dec-7-ene-5,6,10-triol > -1.789874464 > 0 > 3 > 0 > 12.648891477251947 > 11.82243702540425 > -3.7225975182367437 > 82.45 > 44.02139999999999 > 0 > 1 > (1R,2R,4S,5R,6R,10R)-7-methyl-3,9-dioxatricyclo[4.4.0.0^{2,4}]dec-7-ene-5,6,10-triol > 0 > NP0249598 > (1r,2r,4s,5r,6r,10r)-7-methyl-3,9-dioxatricyclo[4.4.0.0²,⁴]dec-7-ene-5,6,10-triol $$$$