763 oechem 14 - 11261916483 d 15 0 0 0 0 0 0 0999 V2000型2.8450 0.8519 0.0118 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0511 -1.2806 -0.0014 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5155 -0.4236 -0.0062 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7823 -0.9325 0.0081 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2141 1.2748 0.0013 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5147 0.6071 -0.0139 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7516 -0.0223 0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8525 -0.0749 -0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4442 1.2342 0.8815 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4508 1.2137 -0.9238 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5999 -1.9302 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7520 -0.6357 0.0144 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2084 1.4754 0.0067 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5875 2.0717 -0.0048 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7335 0.4362 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 15 0 0 0 0 1 1 0 0 0 0 2 8 2 0 0 0 0 3 1 6 0 0 0 0 3 7 2 0 0 0 0 4 7 1 0 0 0 0 4 11 1 0 0 0 0 4 12 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 M >结束
DB02751 >
drugbank >
PUBCHEM >
https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/BPMFZUMJYQTVII-UHFFFAOYSA-N/SDF?record_type = 3 d >
数控(N) = NCC (O) = O >
InChI = 1 s / C3H7N3O2 c4-3 (5) 6-1-2 (7) 8 / h1H2 (H, 7, 8) (H4, 4、5、6) >
BPMFZUMJYQTVII-UHFFFAOYSA-N >
C3H7N3O2 >
117.1066 >
117.053826483 >
5 >
15 >
10.574509629381675 >
1 >
3 >
0 >
0 >
2 - [(diaminomethylidene)氨基]乙酸>
-1.57 >
-3.1801836382121538 >
-0.80 >
0 >
0 >
0 >
3.2489504021985325 >
11.777680548302877 >
101.69999999999999 >
26.425200000000004 >
2 >
1 >
1.87 e + 1 g / l >
(2)2 - {((1)1 - {[(1)1-carbamoyl-2-carboxyethyl][氨基甲酰}2-phenylethyl]氨基}4-phenylbutanoic酸>
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