449593 -OEChem-10051719483D 20 19 0 0 0 0 0 0 0999 V2000 3.2636 -0.8146 -0.0135 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3675 1.2721 -0.0201 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0567 -0.2368 -0.0481 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6188 -0.4434 0.0223 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2845 0.3028 0.0412 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7888 0.5292 0.0162 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8958 -0.6669 0.0113 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2219 0.0577 -0.0092 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6855 -1.1017 0.8972 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6661 -1.0853 -0.8664 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2241 0.9324 0.9377 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2282 0.9779 -0.8221 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7719 1.1861 -0.8584 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8259 1.1313 0.9289 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8397 -1.2942 -0.8852 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8705 -1.3086 0.8988 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1611 -0.8662 0.7589 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1106 -0.8110 -0.8999 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8698 0.3932 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1282 -0.3512 -0.0264 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 20 1 0 0 0 0 2 8 2 0 0 0 0 3 6 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 6 13 1 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 7 16 1 0 0 0 0 M CHG 1 3 1 M END > DB02068 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/JJMDCOVWQOJGCB-UHFFFAOYSA-O/SDF?record_type=3d > [NH3+]CCCCC(O)=O > InChI=1S/C5H11NO2/c6-4-2-1-3-5(7)8/h1-4,6H2,(H,7,8)/p+1 > JJMDCOVWQOJGCB-UHFFFAOYSA-O > C5H12NO2 > 118.1543 > 118.086803633 > 2 > 20 > 0.0008594475023577797 > 12.993218981955758 > 1 > 2 > 1 > 0 > 4-carboxybutan-1-aminium > -2.37 > -2.441462136430473 > -1.17 > 0 > 0 > 0 > 0 > 4.6510543313288055 > 10.205972024771656 > 64.94 > 41.351600000000005 > 4 > 1 > 1.03e+01 g/l > tetrahydrofolic acid > 0 $$$$