Mrv1652309062203192D 14 14 0 0 0 0 999 V2000 -0.7145 4.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 3.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 3.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 3.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 1.2375 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 3 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 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 7 13 1 0 0 0 0 13 14 1 0 0 0 0 M END > NP0223280 > NP-MRD > COC(=O)\C=C\C1=CC=C(O)C=C1O > InChI=1S/C10H10O4/c1-14-10(13)5-3-7-2-4-8(11)6-9(7)12/h2-6,11-12H,1H3/b5-3+ > MAEVSPLUELJOMM-HWKANZROSA-N > C10H10O4 > 194.186 > 194.057908802 > 3 > 24 > 19.158389518926857 > 1 > 2 > 0 > 1 > methyl (2E)-3-(2,4-dihydroxyphenyl)prop-2-enoate > 1.9081830060000002 > 0 > 1 > 0 > 10.398892579029233 > 9.039016955745444 > -5.649455433743154 > 66.76 > 51.7908 > 3 > 1 > methyl (2E)-3-(2,4-dihydroxyphenyl)prop-2-enoate > 0 > NP0223280 > methyl (2e)-3-(2,4-dihydroxyphenyl)prop-2-enoate $$$$