HMDB0011170 RDKit 3D gamma-Glutamylisoleucine 38 37 0 0 0 0 0 0 0 0999 V2000 4.0935 1.1099 -1.4347 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1632 0.4141 -0.0918 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8029 0.2639 0.5342 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8898 -0.4298 1.8619 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8253 -0.4923 -0.3381 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5645 -0.5527 0.3996 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6301 0.0108 -0.1084 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6876 0.5981 -1.2221 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8659 -0.0889 0.6935 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0419 0.5706 -0.0105 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2761 0.4393 0.8521 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.5696 -0.9538 1.0736 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4075 1.0212 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4137 0.3629 -0.2633 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3521 2.3632 -0.2412 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 -1.8671 -0.6376 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5692 -2.8562 -0.2422 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4266 -2.1663 -1.3359 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9690 1.7918 -1.5305 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0274 0.3832 -2.2467 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2006 1.7969 -1.3886 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7728 1.0308 0.6148 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6401 -0.5800 -0.1555 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4267 1.3082 0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6633 -1.5171 1.7378 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8942 -0.3543 2.3194 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1643 0.0279 2.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7071 0.0332 -1.3022 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5805 -1.0305 1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6695 0.3984 1.6661 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0922 -1.1556 0.8663 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7865 1.6361 -0.1717 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2392 0.0854 -0.9736 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1428 0.9280 1.8405 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5519 -1.1287 1.3807 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2599 -1.5773 0.3074 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0920 2.8841 -0.6713 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4264 -2.7075 -2.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 3 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 11 13 1 0 13 14 2 0 13 15 1 0 5 16 1 0 16 17 2 0 16 18 1 0 1 19 1 0 1 20 1 0 1 21 1 0 2 22 1 0 2 23 1 0 3 24 1 1 4 25 1 0 4 26 1 0 4 27 1 0 5 28 1 6 6 29 1 0 9 30 1 0 9 31 1 0 10 32 1 0 10 33 1 0 11 34 1 1 12 35 1 0 12 36 1 0 15 37 1 0 18 38 1 0 M END