HCID36276

3-(1,2-dimethylheptyl)-7,8,9,10-tetrahydro-6,6,9-trimethyl-6H-dibenzo(b,d)pyran-1-ol

6,6,9-trimethyl-3-(3-methyloctan-2-yl)-7,8,9,10-tetrahydrobenzo[c]chromen-1-ol

C25H38O2370.6 g/molCAS 32904-22-6

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IDENTITY

结构与身份

标准 SMILES: CCCCCC(C)C(C)c1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C)CC1
InChIKey: QBEFIFWEOSUTKV-UHFFFAOYSA-N
分子式: C25H38O2
平均分子量: 370.6 g/mol
单同位素质量: 370.28718045

COMPUTED

结构计算性质

已同步

XLogP: 7.3
极性表面积: 29.5 Å²
氢键供体: 1
氢键受体: 2
可旋转键: 6
重原子: 27
形式电荷: 0
复杂度: 534

ALIASES

名称与别名

共 48 条

32904-22-63-(1,2-Dimethylheptyl)-7,8,9,10-tetrahydro-6,6,9-trimethyl-6H-dibenzo(b,d)pyran-1-ol3-(1,2-Dimethylheptyl)-7,8,9,10-tetrahydro-6,6,9-trimethyl-6H-dibenzo[b,d]pyran-1-olRefChem:92038DIMETHYLHEPTYLPYRANDMHPAbbott 40824SP 8EA 1476944O1KA97GNSC-255166,6,9-trimethyl-3-(3-methyloctan-2-yl)-7,8,9,10-tetrahydrobenzo[c]chromen-1-oldelta(sup 3)-ThcDimethylheptyl-delta6a,10a-tetrahydrocannabinolNSC 25516BRN 0313640UNII-944O1KA97GSP-8delta(3,4)-DimethylheptyltetrahydrocannabinolABT 40824

REACTIONS

参与反应

5 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

HRID267351

uspto-grants-1976_03

作为反应物

uspto-grants-1976_03 · 10.6084/m9.figshare.5104873.v1 · US03941782

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HRID816802

Test data from https://doi.org/10.1039/C8SC04228D

作为反应物

Test data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D

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HRID1125453

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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HRID2398887

uspto-grants-1977_05

作为反应物

uspto-grants-1977_05 · 10.6084/m9.figshare.5104873.v1 · US04025630

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HRID2398888

uspto-grants-1977_05

作为反应物

uspto-grants-1977_05 · 10.6084/m9.figshare.5104873.v1 · US04025630

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