Chemical ID: 7352800

Cc1cc(=O)oc2c1c(cc3c2CCC(O3)(C)C)OCC(=O)NCCCOC
Chemical ID:
7352800
Name [?]:
None
SMILES [?]:
Cc1cc(=O)oc2c1c(cc3c2CCC(O3)(C)C)OCC(=O)NCCCOC
InChi [?]:
InChI=1/C21H27NO6/c1-13-10-18(24)27-20-14-6-7-21(2,3)28-15(14)11-16(19(13)20)26-12-17(23)22-8-5-9-25-4/h10-11H,5-9,12H2,1-4H3,(H,22,23)
InChi Info:
AuxInfo=1/1/N:1,17,18,28,25,13,14,24,26,3,10,20,2,12,11,9,21,4,8,7,15,23,22,5,27,19,6,16/E:(2,3)/rA:28nCCCCOOCCCCCCCCCOCCOCCONCCCOC/rB:s1;d2;s3;d4;s4;s6;s2s7;d8;s9;d10;d7s11;s12;s13;s14;s11s15;s15;s15;s9;s19;s20;d21;s21;s23;s24;s25;s26;s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H27NO6
All Atoms:55
Heavy Atoms:28
Chiral Atoms:None
ZAP Information [?]
Total:8.82673
Area:613.827
Solvation:-6.51895
Coulombic:-61.0301
Bond Count [?]
All:30
Single:24
Double:6
Rotors:8
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:2.38
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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