Chemical ID: 3966276

COc1cc(cc(c1OC)OC)CC2C(COC2=O)Cc3ccc4c(c3)OCO4
Chemical ID:
3966276
Name [?]:
4-(benzo[1,3]dioxol-5-ylmethyl)-3-[(3,4,5-trimethoxyphenyl)methyl]tetrahydrofuran-2-one
SMILES [?]:
COc1cc(cc(c1OC)OC)CC2C(COC2=O)Cc3ccc4c(c3)OCO4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H24O7
All Atoms:29
Heavy Atoms:29
Chiral Atoms:2
ZAP Information [?]
Total:5.68643
Area:606.517
Solvation:-9.47649
Coulombic:-55.0822
Bond Count [?]
All:32
Single:25
Double:7
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:400.422
H-Bond Donors:0
H-Bond Acceptors:7
XLogP:2.8
LogP (Chemaxon):3.12

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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