Mrv1652309052210432D 14 13 0 0 1 0 999 V2000 -0.1914 -0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2375 -0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 -1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6664 -0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3809 -1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0954 -1.5395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8099 -1.9520 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8099 -2.7770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5243 -1.5395 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5243 -0.7145 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2388 -1.9520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9533 -1.5395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2388 -2.7770 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 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 3 0 0 0 0 7 8 1 0 0 0 0 8 9 1 1 0 0 0 8 10 1 0 0 0 0 10 11 1 6 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 M END > NP0210768 > NP-MRD > CCCCCC#C[C@H](O)[C@H](O)C(O)=O > InChI=1S/C10H16O4/c1-2-3-4-5-6-7-8(11)9(12)10(13)14/h8-9,11-12H,2-5H2,1H3,(H,13,14)/t8-,9-/m0/s1 > VSKXYKGCLVJSEW-IUCAKERBSA-N > C10H16O4 > 200.234 > 200.104858995 > 4 > 30 > 21.83003180870547 > 1 > 3 > 0 > 1 > (2S,3S)-2,3-dihydroxydec-4-ynoic acid > 1.3838153846666663 > 0 > 0 > -1 > 12.497060129713105 > 3.612758533825645 > -3.937759084102008 > 77.76 > 51.5387 > 7 > 1 > (2S,3S)-2,3-dihydroxydec-4-ynoic acid > 0 > NP0210768 > (2s,3s)-2,3-dihydroxydec-4-ynoic acid $$$$