CAS号:68441-17-8-聚氧化乙烯 - 6-Hydroxy-5-methyl-4,11-dioxoundecanoic acid-科华智慧

1. 主信息

英文名:	6-Hydroxy-5-methyl-4,11-dioxoundecanoic acid
中文名:	聚氧化乙烯
CAS编号:	68441-17-8
化学分子式：	C₁₂H₂₀O₅
化学分子量：	244.28 g/mol
SMILES：	CC(C(CCCCC=O)O)C(=O)CCC(=O)O
来源：	合成化合物
结构类型：	-
其它名称或标识：	-

2. 供应商与价格

供应商	包装规格	含量	价格(元)	环境要求	货期	说明
科华智慧	25g	average Mv ~200,000,powder	128	RT	现货	-
科华智慧	100g	average Mv ~200,000,powder	384	RT	现货	-
科华智慧	25g	average Mv ~500,000,powder	115	RT	现货	-
科华智慧	100g	average Mv ~500,000,powder	352	RT	现货	-
科华智慧	25g	average Mv ~800,000,powder	115	RT	现货	-
科华智慧	100g	average Mv ~800,000,powder	352	RT	现货	-
科华智慧	25g	average Mv ~2000,000,powder	115	RT	现货	-
科华智慧	100g	average Mv ~2000,000,powder	352	RT	现货	-
科华智慧	25g	average Mv 100,000, powder	102	RT	现货	-
科华智慧	100g	average Mv 100,000, powder	256	RT	现货	-
科华智慧	25g	average Mv ~300,000,powder	88	RT	现货	-
科华智慧	100g	average Mv ~300,000,powder	320	RT	现货	-
科华智慧	25g	average Mv ~600,000,powder	88	RT	现货	-
科华智慧	100g	average Mv ~600,000,powder	320	RT	现货	-
科华智慧	25g	average Mv ~1,000,000,powder	57	RT	现货	-
科华智慧	100g	average Mv ~1,000,000,powder	179	RT	现货	-
科华智慧	25g	average Mv ~5,000,000,powder	64	RT	现货	-
科华智慧	100g	average Mv ~5,000,000,powder	140	RT	现货	-
科华智慧	25g	average Mv ~7,000,000,powder	70	RT	现货	-
科华智慧	100g	average Mv ~7,000,000,powder	256	RT	现货	-

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3. 结构

3.1 二维结构

3.2 三维结构

-1 -2 -3 37 36 0 1 0 0 0 0 0999 V2000 -0.4614 3.4278 -1.0816 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4118 1.3036 -1.0724 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3525 -3.6322 -0.7407 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1014 -1.7637 -0.9155 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9492 -3.2659 1.0129 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1179 2.6566 -0.0282 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0071 1.9722 0.7753 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1531 1.7002 -0.6388 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9084 0.9088 0.4376 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7896 0.9597 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9531 -0.0202 -0.1903 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9689 2.9828 1.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7567 -0.4878 0.4084 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7512 -0.7920 0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5643 -1.4329 -0.4773 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8398 -1.6657 0.2784 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5635 -2.8514 0.0414 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6361 3.3638 0.6316 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5554 1.4255 1.6111 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8679 2.2808 -1.2363 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6679 1.0169 -1.3464 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2226 0.3031 1.0359 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4047 1.6076 1.1218 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4578 -0.7284 -0.8663 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6412 0.5705 -0.8082 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4989 3.5628 0.6378 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7271 2.4703 2.0034 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 3.6809 2.0521 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1475 -0.5126 1.4322 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7132 -0.8174 0.4344 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2328 -0.0961 1.5528 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0841 -1.4400 1.4359 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 3.9025 -1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6038 -1.0890 -0.5287 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1485 -1.4367 -1.4913 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4189 -2.2380 1.0238 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3694 -4.5625 -0.4299 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 33 1 0 0 0 0 2 10 2 0 0 0 0 3 17 1 0 0 0 0 3 37 1 0 0 0 0 4 16 2 0 0 0 0 5 17 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 18 1 0 0 0 0 7 10 1 0 0 0 0 7 12 1 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 9 11 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 13 1 0 0 0 0 11 14 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 15 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 16 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 17 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0

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4. 国际命名与标识

4.1 IUPAC Name

6-hydroxy-5-methyl-4,11-dioxoundecanoic acid

4.2 InChl

InChI=1S/C12H20O5/c1-9(11(15)6-7-12(16)17)10(14)5-3-2-4-8-13/h8-10,14H,2-7H2,1H3,(H,16,17)

4.3 InChlKey

AZUZXOSWBOBCJY-UHFFFAOYSA-N

4.4 Canonical SMILES

CC(C(CCCCC=O)O)C(=O)CCC(=O)O

4.5 lsomeric SMILES

4.6 SDF文件

补充中

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5. 波谱数据

5.1 ¹³C核磁共振谱(¹³C NMR)

5.2 ¹H核磁共振谱(¹H NMR)

5.3 质谱(MS)

补充中

5.4 红外光谱(IR)

补充中

5.5 紫外/可见光谱(UV/Vis)

补充中

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6. 相关药材

中文名称

英文名称

拉丁文名称

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7. 相关靶点

基因靶点

靶点位置

参考文献

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8. 相关疾病

疾病名称

疾病类型