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Chemical ID: 7518756

CCOc1ccc(cc1)C2c3c(=O)c4ccccc4oc3C(=O)N2CCc5ccc(cc5)OC

Chemical ID:

7518756

Name [?]:

None

SMILES [?]:

CCOc1ccc(cc1)C2c3c(=O)c4ccccc4oc3C(=O)N2CCc5ccc(cc5)OC

InChi [?]:

InChI=1/C28H25NO5/c1-3-33-21-14-10-19(11-15-21)25-24-26(30)22-6-4-5-7-23(22)34-27(24)28(31)29(25)17-16-18-8-12-20(32-2)13-9-18/h4-15,25H,3,16-17H2,1-2H3

InChi Info:

AuxInfo=1/0/N:1,34,2,16,17,15,18,28,32,6,8,29,31,5,9,26,25,27,7,30,4,14,19,11,10,12,21,22,24,13,23,33,3,20/E:(8,9)(10,11)(12,13)(14,15)/rA:34cCCOCCCCCCCCCOCCCCCCOCCONCCCCCCCCOC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s7;s10;s11;d12;s12;s14;d15;s16;d17;d14s18;s19;d11s20;s21;d22;s10s22;s24;s25;s26;s27;d28;s29;d30;d27s31;s30;s33;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₈H₂₅NO₅
All Atoms:	59
Heavy Atoms:	34
Chiral Atoms:	None

ZAP Information [?]

Total:	11.5553
Area:	696.553
Solvation:	-5.85849
Coulombic:	-51.1146

Bond Count [?]

All:	38
Single:	26
Double:	12
Rotors:	7
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	4.54
LogP (Chemaxon):	None

Name Annotations

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

Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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

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