441445 -OEChem-03282407242D 37 37 0 1 0 0 0 0 0999 V2000 4.8660 1.1160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 1.1160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3660 1.9820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8660 2.8481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 -0.6160 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3660 0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -1.4820 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5000 -0.9821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -1.9820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 -1.4820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 -0.6160 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0000 -2.8481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3660 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3660 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8660 1.1160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8660 1.1160 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.3660 1.9820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5265 -0.8832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7120 -0.3994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8894 -0.8744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2584 -2.0926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9486 -1.6941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1760 -1.1530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -2.8481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -3.3850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1760 -1.1530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2584 -0.3606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9486 0.0379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9737 1.7266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2834 1.3281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4860 1.1160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5560 1.6530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9860 0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0560 -0.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6760 2.5190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 34 1 0 0 0 0 2 14 2 0 0 0 0 3 15 2 0 0 0 0 4 19 1 0 0 0 0 4 37 1 0 0 0 0 5 19 2 0 0 0 0 12 6 1 1 0 0 0 6 15 1 0 0 0 0 6 28 1 0 0 0 0 18 7 1 1 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 1 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 13 2 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 12 14 1 0 0 0 0 12 25 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 M END > 441445 > 1 > 407 > 6 > 4 > 8 > AAADceBzOAAAAAAAAAAAAAAAGAAAAAAAAAAAAAAAAAAAAAAAAAAAHgAQCAAADSjBgAQACALAAgCIAgHSGAAAAAAgAAAAAIGIAAgCABIAgSAEQAAElgCQAAGcXwIMAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > (2S)-2-amino-5-[[(1S)-1-carboxy-2-[(1S)-2-methylenecyclopropyl]ethyl]amino]-5-oxo-pentanoic acid > (2S)-2-amino-5-[[(1S)-1-carboxy-2-[(1S)-2-methylenecyclopropyl]ethyl]amino]-5-oxopentanoic acid > (2S)-2-amino-5-[[(1S)-1-carboxy-2-[(1S)-2-methylidenecyclopropyl]ethyl]amino]-5-oxopentanoic acid > (2S)-2-amino-5-[[(1S)-1-carboxy-2-[(1S)-2-methylidenecyclopropyl]ethyl]amino]-5-oxopentanoic acid > (2S)-2-azanyl-5-[[(2S)-3-[(1S)-2-methylidenecyclopropyl]-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid > (2S)-2-amino-5-[[(1S)-1-carboxy-2-[(1S)-2-methylenecyclopropyl]ethyl]amino]-5-keto-valeric acid > InChI=1S/C12H18N2O5/c1-6-4-7(6)5-9(12(18)19)14-10(15)3-2-8(13)11(16)17/h7-9H,1-5,13H2,(H,14,15)(H,16,17)(H,18,19)/t7-,8-,9-/m0/s1 > UYDZYCPIQSRXKU-CIUDSAMLSA-N > -3.2 > 270.12157168 > C12H18N2O5 > 270.28 > C=C1CC1CC(C(=O)O)NC(=O)CCC(C(=O)O)N > C=C1C[C@H]1C[C@@H](C(=O)O)NC(=O)CC[C@@H](C(=O)O)N > 130 > 270.12157168 > 0 > 19 > 3 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 12 6 5 18 7 5 8 11 5 $$$$