CAS号:502-72-7-环十五烷酮 - Cyclopentadecanone-科华智慧

1. 主信息

英文名:	Cyclopentadecanone
中文名:	环十五烷酮
CAS编号:	502-72-7
化学分子式：	C₁₅H₂₈O
化学分子量：	224.38 g/mol
SMILES：	C1CCCCCCCC(=O)CCCCCC1
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	20mg	GC≥98%	256	2-8℃	现货	-

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3. 结构

3.1 二维结构

3.2 三维结构

-1 -2 -3 44 44 0 0 0 0 0 0 0999 V2000 -2.5822 0.1776 -1.6728 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9980 -0.5146 0.3486 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3817 0.8304 -0.2806 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5312 -1.5338 -0.6961 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1759 1.7090 -0.6408 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9969 -2.8325 -0.0828 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 2.3927 0.5867 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7053 -2.6934 0.7326 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 3.2594 0.2503 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4671 -2.1376 -0.0795 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9097 2.4906 -0.1832 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7476 -2.0692 0.7579 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4611 1.5721 0.9131 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9347 -1.5390 -0.0403 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8298 0.9863 0.5729 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7648 -0.0980 -0.4861 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2361 -0.3620 1.1175 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8786 -0.9248 0.8583 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9761 0.6495 -1.1845 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0307 1.3781 0.4137 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3855 -1.7864 -1.3375 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7791 -1.0991 -1.3608 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4241 1.1181 -1.1716 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5130 2.4873 -1.3368 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7710 -3.2731 0.5574 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8219 -3.5501 -0.8943 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3252 3.0417 1.0367 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2999 1.6585 1.3535 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8798 -2.0636 1.6119 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4363 -3.6860 1.1153 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6156 3.9674 -0.5426 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0971 3.8648 1.1313 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6361 -2.7698 -0.9594 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2225 -1.1346 -0.4422 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6991 1.9156 -1.0903 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6780 3.2261 -0.4523 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5781 -1.4457 1.6431 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9939 -3.0742 1.1216 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5591 2.1492 1.8407 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7511 0.7637 1.1122 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8512 -1.6007 0.5573 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1001 -2.1576 -0.9303 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5221 1.7624 0.2277 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2752 0.5566 1.4775 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 2 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 5 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 6 1 0 0 0 0 4 21 1 0 0 0 0 4 22 1 0 0 0 0 5 7 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 8 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 9 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 10 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 11 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 12 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 13 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 14 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 15 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 16 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0

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4. 国际命名与标识

4.1 IUPAC Name

cyclopentadecanone

4.2 InChl

InChI=1S/C15H28O/c16-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-15/h1-14H2

4.3 InChlKey

OSOIQJGOYGSIMF-UHFFFAOYSA-N

4.4 Canonical SMILES

C1CCCCCCCC(=O)CCCCCC1

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
木防己	Japanese Snailseed	Cocculus trilobus [Syn. Cocculus sarmentosus]
三尖杉	Fortune Plumyew	Cephalotaxus fortunei
麝香	Abelmusk	Moschus moschiferus, Moschus berezovskii, Moschus
麝香草酸	-	Acidum Thymici
香精	Essence	Essentia

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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