Basic information
- CAS
1207182-50-0- Standard SMILES
C1CCCCC23CCCCCC45CCCCCCCCC4(CCCCCC2(CCC1)O3)O5- InChIKey
XVGPDAFFXRGERF-UHFFFAOYSA-N- Molecular formula
- C30H52O2
- Average molar mass
- 444.7 g/mol
- Monoisotopic mass
- 444.3967309
Overview
Tricyclo[20.8.0.0(7,16)]triacontane, 1(22),7(16)-diepoxy- has been reported in Cyperus rotundus with data available.
Names & identifiers
- Preferred name
- Tricyclo(20.8.0.0(7,16))triacontane, 1(22),7(16)-diepoxy-
- IUPAC
- 31,32-dioxapentacyclo[20.8.1.17,16.01,22.07,16]dotriacontane
Names & synonyms
Tricyclo[20.8.0.0(7,16)]triacontane, 1(22),7(16)-diepoxy-DTXSID6010163731207182-50-031,32-dioxapentacyclo(20.8.1.17,16.01,22.07,16)dotriacontane31,32-dioxapentacyclo[20.8.1.17,16.01,22.07,16]dotriacontaneTricyclo(20.8.0.0(7,16))triacontane, 1(22),7(16)-diepoxy-RefChem:385946DTXCID501474552XVGPDAFFXRGERF-UHFFFAOYSA-Ntricyclo(20,8,0,0(7,16)tricontane,1(22),7(16)diepoxyTetracosahydro-9H,22H-8a,26a:13a,21a-diepoxydicyclodeca[a,h][14]annulene
Database identifiers
- CAS
1207182-50-0- PubChem CID
- 543764
- DTXSID
DTXSID601016373
Properties
Computed structural properties
- XLogP
- 9.5
- Topological polar surface area
- 25.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 504
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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