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Chemical ID: 7741672
Chemical ID:
7741672
Name [?]:
None
SMILES [?]:
CCCCOc1ccc(cc1)C(=O)N2CCC3(CC2)CC(=O)c4ccccc4O3
InChi [?]:
InChI=1/C24H27NO4/c1-2-3-16-28-19-10-8-18(9-11-19)23(27)25-14-12-24(13-15-25)17-21(26)20-6-4-5-7-22(20)29-24/h4-11H,2-3,12-17H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,3,25,26,24,27,8,10,7,11,16,18,15,19,4,20,9,6,23,21,28,12,17,14,22,13,5,29/E:(8,9)(10,11)(12,13)(14,15)/rA:29nCCCCOCCCCCCCONCCCCCCCOCCCCCCO/rB:s1;s2;s3;s4;s5;s6;d7;s8;d9;d6s10;s9;d12;s12;s14;s15;s16;s17;s14s18;s17;s20;d21;s21;s23;d24;s25;d26;d23s27;s17s28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C24H27NO4 |
All Atoms: | 56 |
Heavy Atoms: | 29 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 10.9344 |
Area: | 617.875 |
Solvation: | -4.51246 |
Coulombic: | -41.978 |
Bond Count [?]
All: | 32 |
Single: | 24 |
Double: | 8 |
Rotors: | 6 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 4.56 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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