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Chemical ID: 7741673

COc1ccc(c(c1)OC)C(=O)N2CCC3(CC2)CC(=O)c4ccccc4O3

Chemical ID:

7741673

Name [?]:

None

SMILES [?]:

COc1ccc(c(c1)OC)C(=O)N2CCC3(CC2)CC(=O)c4ccccc4O3

InChi [?]:

InChI=1/C22H23NO5/c1-26-15-7-8-17(20(13-15)27-2)21(25)23-11-9-22(10-12-23)14-18(24)16-5-3-4-6-19(16)28-22/h3-8,13H,9-12,14H2,1-2H3

InChi Info:

AuxInfo=1/0/N:1,10,24,25,23,26,4,5,15,17,14,18,8,19,3,22,6,20,27,7,11,16,13,21,12,2,9,28/E:(9,10)(11,12)/rA:28nCOCCCCCCOCCONCCCCCCCOCCCCCCO/rB:s1;s2;s3;d4;s5;d6;d3s7;s7;s9;s6;d11;s11;s13;s14;s15;s16;s13s17;s16;s19;d20;s20;s22;d23;s24;d25;d22s26;s16s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₂H₂₃NO₅
All Atoms:	51
Heavy Atoms:	28
Chiral Atoms:	None

ZAP Information [?]

Total:	7.91645
Area:	568.536
Solvation:	-6.29695
Coulombic:	-46.6732

Bond Count [?]

All:	31
Single:	23
Double:	8
Rotors:	4
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	3.12
LogP (Chemaxon):	None

Name Annotations

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Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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Chemical Mix	Source	External ID	Descriptor	Value

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical Mix	Source	External ID	Descriptor	Value