964 oechem - 10051720053 d 11 10 0 0 0 0 0 0 0999 V2000型-2.6044 0.1314 -0.0043 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4155 -1.4818 -0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0194 -0.7972 -0.0026 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4263 1.4192 -0.0135 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3415 0.7662 0.0043 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2494 -0.2714 0.0098 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1651 0.2337 0.0153 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2652 1.3979 0.8935 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 1.3769 -0.8982 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7019 -0.3383 0.8417 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9553 -0.5044 -0.0243 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 10 0 0 0 0 1 1 0 0 0 0 2 6 2 0 0 0 0 3 7 1 0 0 0 0 3 11 1 0 0 0 0 4 7 2 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 1 9 0 0 0 0 6 7 1 0 0 0 0 M >结束
DB02951 >
drugbank >
PUBCHEM >
https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/HHDDCCUIIUWNGJ-UHFFFAOYSA-N/SDF?record_type = 3 d >
OCC (= O) C (O) = O >
InChI = 1 s / C3H4O4 c4-1-2 (5) 3 (6) 7 / h4H 1 h2 (H、6、7) >
HHDDCCUIIUWNGJ-UHFFFAOYSA-N >
C3H4O4 >
104.0615 >
104.010958616 >
4 >
11 >
-0.9999631045463667 >
8.16699861049387 >
1 >
2 >
0 >
0 >
3-hydroxy-2-oxopropanoic酸>
-1.43 >
-0.7513740926666667 >
0.30 >
0 >
1 >
0 >
1 >
14.009436800579357 >
2.56813871486875 >
-3.3936911204379876 >
74.6 >
19.6919 >
2 >
1 >
2.09 e + 2 g / l >
生物素>
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