Mrv1652305271900162D 13 13 0 0 0 0 999 V2000 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 0.0000 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 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 0.0000 2.4750 0.0000 C 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 0.7145 3.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 2.0625 0.0000 O 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 2 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 1 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 8 12 1 0 0 0 0 3 13 1 0 0 0 0 M END > YMDB00457 > YMDB > OC(CC1=CC=C(O)C=C1)C(O)=O > InChI=1S/C9H10O4/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8,10-11H,5H2,(H,12,13) > JVGVDSSUAVXRDY-UHFFFAOYSA-N > C9H10O4 > 182.1733 > 182.057908808 > 4 > 23 > 17.508950163763846 > 1 > 3 > 0 > 1 > 2-hydroxy-3-(4-hydroxyphenyl)propanoic acid > 0.87 > 0.8809315280000001 > -1.58 > 0 > 1 > -1 > 9.50382828900583 > 3.5839647995095922 > -3.8298154633716104 > 77.75999999999999 > 45.439700000000016 > 3 > 1 > 4.79e+00 g/l > hydroxyphenyllactic acid > 0 > YMDB00457 > 3-(4-hydroxyphenyl)lactic acid > (RS)-3-(4-Hydroxyphenyl)lactate; (RS)-3-(4-Hydroxyphenyl)lactic acid; 2-Hydroxy-3-(4-hydroxyphenyl)propanoate; 2-Hydroxy-3-(4-hydroxyphenyl)propanoic acid; 2-Hydroxy-3-(p-hydroxyphenyl)propionate; 2-Hydroxy-3-(p-hydroxyphenyl)propionic acid; 3-(4-Hydroxyphenyl)-DL-lactate; 3-(4-Hydroxyphenyl)-DL-lactic acid; 3-(4-Hydroxyphenyl)lactate; 3-(4-Hydroxyphenyl)lactic acid; 3-(p-hydroxyphenyl)-Lactate; 3-(p-hydroxyphenyl)-Lactic acid; 4-Hydroxyphenyllactate; 4-Hydroxyphenyllactic acid; a,4-Dihydroxybenzenepropanoate; a,4-Dihydroxybenzenepropanoic acid; b-(4-Hydroxyphenyl)lactate; b-(4-Hydroxyphenyl)lactic acid; b-(p-Hydroxyphenyl)-DL-lactate; b-(p-Hydroxyphenyl)-DL-lactic acid; b-(p-Hydroxyphenyl)lactate; b-(p-Hydroxyphenyl)lactic acid; Benzenepropanoic acid, .alpha.,4-dihydroxy-; beta-(4-Hydroxyphenyl)lactate; beta-(4-Hydroxyphenyl)lactic acid; beta-(p-Hydroxyphenyl)-DL-lactate; beta-(p-Hydroxyphenyl)-DL-lactic acid; beta-(p-Hydroxyphenyl)lactate; beta-(p-Hydroxyphenyl)lactic acid; DL-3-(4-Hydroxyphenyl)lactate; DL-3-(4-Hydroxyphenyl)lactic acid; DL-p-Hydroxyphenyllactate; DL-p-Hydroxyphenyllactic acid; HPLA; Hydroxyphenyllactate; Lactic acid, (p-hydroxyphenyl)-; Lactic acid, 3-(p-hydroxyphenyl)-; p-Hydroxyphenyl lactic acid; p-Hydroxyphenyllactate $$$$