Mrv1652309052206242D 14 14 0 0 1 0 999 V2000 0.8649 2.5120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1198 1.7274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5678 1.1143 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0157 1.7274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2352 0.6294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9803 -0.1553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1553 -0.1553 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3297 -0.8227 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1501 -0.7365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6351 -1.4039 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0059 -1.5764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 -2.2438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8264 -1.6626 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0997 0.6294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 3 2 1 1 0 0 0 3 4 1 6 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 6 0 0 0 8 9 1 1 0 0 0 9 10 1 0 0 0 0 8 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 7 14 1 0 0 0 0 3 14 1 0 0 0 0 M END > NP0207694 > NP-MRD > C[C@@]1(CC[C@@H](O1)[C@H](CO)C(O)=O)C=C > InChI=1S/C10H16O4/c1-3-10(2)5-4-8(14-10)7(6-11)9(12)13/h3,7-8,11H,1,4-6H2,2H3,(H,12,13)/t7-,8+,10-/m0/s1 > WLRVIKRNZCNFRS-XKSSXDPKSA-N > C10H16O4 > 200.234 > 200.104858995 > 4 > 30 > 20.807450372149027 > 1 > 2 > 0 > 1 > (2S)-2-[(2R,5R)-5-ethenyl-5-methyloxolan-2-yl]-3-hydroxypropanoic acid > 0.6389186996666663 > 0 > 1 > -1 > 15.427539804257535 > 4.416062148241057 > -2.7330242612772047 > 66.76 > 50.828 > 4 > 1 > (2S)-2-[(2R,5R)-5-ethenyl-5-methyloxolan-2-yl]-3-hydroxypropanoic acid > 0 > NP0207694 > (2s)-2-[(2r,5r)-5-ethenyl-5-methyloxolan-2-yl]-3-hydroxypropanoic acid $$$$