Chemical ID: 6825915

Cc1ccc2c(c1)c(=O)c3c(o2)C(=O)N(C3c4ccc(c(c4)OC)OCC=C)Cc5ccc6c(c5)OCO6
Chemical ID:
6825915
Name [?]:
None
SMILES [?]:
Cc1ccc2c(c1)c(=O)c3c(o2)C(=O)N(C3c4ccc(c(c4)OC)OCC=C)Cc5ccc6c(c5)OCO6
InChi [?]:
InChI=1/C30H25NO7/c1-4-11-35-22-10-7-19(14-24(22)34-3)27-26-28(32)20-12-17(2)5-8-21(20)38-29(26)30(33)31(27)15-18-6-9-23-25(13-18)37-16-36-23/h4-10,12-14,27H,1,11,15-16H2,2-3H3
InChi Info:
AuxInfo=1/0/N:28,1,24,27,3,31,18,4,32,19,26,7,35,22,29,37,2,30,17,6,5,20,33,21,34,10,16,8,11,13,15,9,14,23,25,38,36,12/rA:38cCCCCCCCCOCCOCONCCCCCCCOCOCCCCCCCCCCOCO/rB:s1;s2;d3;s4;d5;d2s6;s6;d8;s8;d10;s5s11;s11;d13;s13;s10s15;s16;s17;d18;s19;d20;d17s21;s21;s23;s20;s25;s26;d27;s15;s29;s30;d31;s32;d33;d30s34;s34;s36;s33s37;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C30H25NO7
All Atoms:63
Heavy Atoms:38
Chiral Atoms:1
ZAP Information [?]
Total:8.58449
Area:669.763
Solvation:-8.15958
Coulombic:-67.0793
Bond Count [?]
All:43
Single:30
Double:13
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:511.522
H-Bond Donors:0
H-Bond Acceptors:7
XLogP:4.5
LogP (Chemaxon):4.82

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