HMDB0031912 RDKit 3D Porric acid A 36 38 0 0 0 0 0 0 0 0999 V2000 -4.2454 -1.8990 1.3864 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2351 -0.5892 0.9213 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1168 0.0950 0.4875 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2348 1.3963 0.0474 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1478 2.1212 -0.3954 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2747 3.5011 -0.8618 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2852 4.1598 -1.2644 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5250 4.1003 -0.8594 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8923 1.5301 -0.4015 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2856 1.9735 -0.7603 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2178 1.0796 -0.6039 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5875 1.1111 -0.8499 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2355 2.2292 -1.3565 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3136 -0.0275 -0.5716 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6806 -0.0580 -0.7951 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4338 -1.2148 -0.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6899 -1.1517 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3211 -1.1945 0.1828 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6822 -2.4191 0.7255 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6011 -0.0527 -0.0976 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7434 0.2225 0.0355 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8373 -0.4639 0.4659 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0750 -2.0064 2.1258 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3190 -2.2032 1.9142 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4827 -2.5867 0.5266 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1985 1.8919 0.0373 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2479 3.9188 -0.1916 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6753 3.0522 -1.5516 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0161 -2.0870 -1.0566 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3670 -1.4698 0.5712 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4931 -1.0972 -0.7511 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2775 -2.0190 0.1391 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2762 -2.2937 1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0237 -2.8906 -0.0008 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4900 -3.1968 0.8409 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7592 -1.4619 0.8056 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 2 0 6 8 1 0 5 9 2 0 9 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 12 14 1 0 14 15 1 0 15 16 1 0 14 17 2 0 17 18 1 0 18 19 1 0 18 20 2 0 20 21 1 0 21 22 2 0 22 3 1 0 21 9 1 0 20 11 1 0 1 23 1 0 1 24 1 0 1 25 1 0 4 26 1 0 8 27 1 0 13 28 1 0 16 29 1 0 16 30 1 0 16 31 1 0 17 32 1 0 19 33 1 0 19 34 1 0 19 35 1 0 22 36 1 0 M END