HCID58764137

6-Cyclopentyl-6-[2-(5-ethyl-4-hydroxy-2-propoxy-phenyl)-ethyl]-dihydro-pyran-2,4-dione

6-cyclopentyl-6-[2-(5-ethyl-4-hydroxy-2-propoxyphenyl)ethyl]oxane-2,4-dione

C23H32O5388.5 g/mol

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IDENTITY

结构与身份

标准SMILES: CCCOc1cc(O)c(CC)cc1CCC1(C2CCCC2)CC(=O)CC(=O)O1
InChIKey: QHRCJOCVEXGWQM-UHFFFAOYSA-N
分子式: C23H32O5
平均分子量: 388.5 g/mol
单同位素质量: 388.22497412

COMPUTED

结构计算性质

已同步

XLogP: 5.1
极性表面积: 72.8 Å²
氢键供体: 1
氢键受体: 5
可旋转键: 8
重原子: 28
形式电荷: 0
复杂度: 541

ALIASES

名称与别名

共 3 条

SCHEMBL1581347QHRCJOCVEXGWQM-UHFFFAOYSA-N6-cyclopentyl-6-[2-(5-ethyl-4-hydroxy-2-propoxy-phenyl)-ethyl]-dihydro-pyran-2,4-dione

REACTIONS

参与反应

7 条

全部作为反应物作为生成物作为试剂作为催化剂作为溶剂

HRID679634

Training data from https://doi.org/10.1039/C8SC04228D (3/10)

作为反应物

Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D

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HRID859693

uspto-grants-2006_12

作为反应物

uspto-grants-2006_12 · 10.6084/m9.figshare.5104873.v1 · US07151105B2

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HRID1120294

Training data from https://doi.org/10.1039/C8SC04228D (7/10)

作为反应物

Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D

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HRID1438277

uspto-grants-2009_11

作为反应物

uspto-grants-2009_11 · 10.6084/m9.figshare.5104873.v1 · US07622605B2

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HRID1438278

uspto-grants-2009_11

作为反应物

uspto-grants-2009_11 · 10.6084/m9.figshare.5104873.v1 · US07622605B2

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HRID2387084

uspto-grants-2012_09

作为反应物

uspto-grants-2012_09 · 10.6084/m9.figshare.5104873.v1 · US08268835B2

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HRID2387085

uspto-grants-2012_09

作为反应物

uspto-grants-2012_09 · 10.6084/m9.figshare.5104873.v1 · US08268835B2

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