(6β,11α,12α)-11,12-epoxy-3,6,13-trihydroxy-2-oxo-24-Norurs-3-en-28-oic acid γ-lactone 数据
Mol:
1404312-43-1.mol by:chem960.com
ChemDraw08031019472D
…………
0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9577 -6.0804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9716 -6.6241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1060 -7.4422 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0382 -7.4807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0424 -4.3844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0135 -6.0612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9824 -4.1238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8766 0.0121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0026 -6.8777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9504 -5.3361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0034 -2.1300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9777 -5.1839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
2 30 1 0 0 0 0
2 32 1 0 0 0 0
3 1 1 0 0 0 0
4 5 2 0 0 0 0
5 31 1 0 0 0 0
5 1 1 0 0 0 0
6 7 1 1 0 0 0
6 8 1 0 0 0 0
6 31 1 0 0 0 0
6 32 1 0 0 0 0
8 9 1 0 0 0 0
8 38 1 6 0 0 0
9 10 1 0 0 0 0
9 37 1 6 0 0 0
10 11 1 0 0 0 0
10 37 1 6 0 0 0
11 24 1 1 0 0 0
12 13 1 1 0 0 0
12 11 1 0 0 0 0
12 19 1 0 0 0 0
14 15 1 1 0 0 0
14 16 1 0 0 0 0
14 12 1 0 0 0 0
16 34 1 6 0 0 0
16 17 1 0 0 0 0
17 18 1 0 0 0 0
19 20 1 0 0 0 0
19 22 1 1 0 0 0
19 18 1 0 0 0 0
20 21 1 0 0 0 0
21 25 1 0 0 0 0
22 23 2 0 0 0 0
24 22 1 0 0 0 0
25 26 1 0 0 0 0
25 11 1 0 0 0 0
25 36 1 6 0 0 0
26 27 1 0 0 0 0
26 8 1 0 0 0 0
26 33 1 1 0 0 0
27 28 1 0 0 0 0
28 29 1 1 0 0 0
32 28 1 0 0 0 0
32 35 1 6 0 0 0
M END
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(6β,11α,12α)-11,12-epoxy-3,6,13-trihydroxy-2-oxo-24-Norurs-3-en-28-oic acid γ-lactone Smile 编码:
C1(C(C[C@]2([C@@]([H])([C@H](O)C[C@]3(C)[C@]2([H])[C@@H]2O[C@@H]2[C@@]24[C@@]3(C)CC[C@]3(CC[C@@H](C)[C@@H]([C@@]23[H])C)C(O4)=O)C=1C)C)=O)O
(6β,11α,12α)-11,12-epoxy-3,6,13-trihydroxy-2-oxo-24-Norurs-3-en-28-oic acid γ-lactone InChi 编码:
(6β,11α,12α)-11,12-epoxy-3,6,13-trihydroxy-2-oxo-24-Norurs-3-en-28-oic acid γ-lactone InChiKey 编码:
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(6β,11α,12α)-11,12-epoxy-3,6,13-trihydroxy-2-oxo-24-Norurs-3-en-28-oic acid γ-lactone
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