Chemical ID: 7380934

CCOc1cc(ccc1O)C2c3c(=O)c4cc(cc(c4oc3C(=O)N2CCCO)C)C
Chemical ID:
7380934
Name [?]:
None
SMILES [?]:
CCOc1cc(ccc1O)C2c3c(=O)c4cc(cc(c4oc3C(=O)N2CCCO)C)C
InChi [?]:
InChI=1/C24H25NO6/c1-4-30-18-12-15(6-7-17(18)27)20-19-21(28)16-11-13(2)10-14(3)22(16)31-23(19)24(29)25(20)8-5-9-26/h6-7,10-12,20,26-27H,4-5,8-9H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,31,30,2,27,7,8,26,28,18,16,5,17,19,6,15,9,4,12,11,13,20,22,23,25,29,10,14,24,3,21/rA:31cCCOCCCCCCOCCCOCCCCCCOCCONCCCOCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s6;s11;s12;d13;s13;s15;d16;s17;d18;d15s19;s20;d12s21;s22;d23;s11s23;s25;s26;s27;s28;s19;s17;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H25NO6
All Atoms:56
Heavy Atoms:31
Chiral Atoms:1
ZAP Information [?]
Total:9.51484
Area:651.833
Solvation:-6.78098
Coulombic:-74.0825
Bond Count [?]
All:34
Single:25
Double:9
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:423.458
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:2.66
LogP (Chemaxon):3.0

Name Annotations

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

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

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

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

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

Chemical MixSourceExternal IDDescriptorValue