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Chemical ID: 7654915

Cc1cc(cc(c1CC(C(=O)O)NC(=O)OC(C)(C)C)C)OCc2ccccc2

Chemical ID:

7654915

Name [?]:

None

SMILES [?]:

Cc1cc(cc(c1CC(C(=O)O)NC(=O)OC(C)(C)C)C)OCc2ccccc2

InChi [?]:

InChI=1/C23H29NO5/c1-15-11-18(28-14-17-9-7-6-8-10-17)12-16(2)19(15)13-20(21(25)26)24-22(27)29-23(3,4)5/h6-12,20H,13-14H2,1-5H3,(H,24,27)(H,25,26)

InChi Info:

AuxInfo=1/1/N:1,21,18,19,20,27,26,28,25,29,3,5,8,23,2,6,24,4,7,9,10,14,17,13,11,12,15,22,16/E:(1,2)(3,4,5)(7,8)(9,10)(11,12)(15,16)(25,26)/rA:29cCCCCCCCCCCOONCOOCCCCCOCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s9;d10;s10;s9;s13;d14;s14;s16;s17;s17;s17;s6;s4;s22;s23;s24;d25;s26;d27;d24s28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₃H₂₉NO₅
All Atoms:	58
Heavy Atoms:	29
Chiral Atoms:	None

ZAP Information [?]

Total:	11.7278
Area:	642.599
Solvation:	-4.33721
Coulombic:	-69.8009

Bond Count [?]

All:	30
Single:	22
Double:	8
Rotors:	10
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	5.03
LogP (Chemaxon):	None

Name Annotations

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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