HMDB0029126 RDKit 3D Valylglutamic acid 35 34 0 0 0 0 0 0 0 0999 V2000 -3.9835 1.2206 0.4618 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8374 0.4464 -0.2182 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8536 -0.9154 0.4217 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5970 1.2502 0.0808 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8727 2.5789 -0.5139 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3845 0.7162 -0.5485 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1388 1.3669 -1.5144 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -0.4898 -0.1088 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 -0.9702 -0.7432 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4954 -1.3350 0.1769 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0299 -0.2604 1.0497 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5863 0.8756 0.2716 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8656 1.7954 -0.1552 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9678 0.9277 0.0002 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0445 -2.2325 -1.4991 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -2.6628 -1.4725 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0515 -2.8635 -2.1961 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9389 0.6661 0.3439 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1089 2.2061 0.0039 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7625 1.2826 1.5415 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0112 0.4069 -1.3029 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4834 -0.9153 1.4473 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9146 -1.3107 0.4644 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3396 -1.6225 -0.2559 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4572 1.3756 1.1601 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2742 3.2167 0.2034 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0348 2.9515 -0.9782 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2361 -0.9997 0.6789 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7334 -0.2143 -1.4872 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 -1.6898 -0.4677 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2556 -2.2082 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8927 -0.7078 1.6166 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2983 0.1208 1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3534 1.6779 -0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5498 -3.6842 -1.8814 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 4 6 1 0 6 7 2 0 6 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 9 15 1 0 15 16 2 0 15 17 1 0 1 18 1 0 1 19 1 0 1 20 1 0 2 21 1 0 3 22 1 0 3 23 1 0 3 24 1 0 4 25 1 1 5 26 1 0 5 27 1 0 8 28 1 0 9 29 1 6 10 30 1 0 10 31 1 0 11 32 1 0 11 33 1 0 14 34 1 0 17 35 1 0 M END