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Chemical ID: 7741665
Chemical ID:
7741665
Name [?]:
None
SMILES [?]:
CC(C)(C)c1ccc(cc1)C(=O)N2CCC3(CC2)CC(=O)c4ccccc4O3
InChi [?]:
InChI=1/C24H27NO3/c1-23(2,3)18-10-8-17(9-11-18)22(27)25-14-12-24(13-15-25)16-20(26)19-6-4-5-7-21(19)28-24/h4-11H,12-16H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,3,4,24,25,23,26,7,9,6,10,15,17,14,18,19,8,5,22,20,27,11,2,16,13,21,12,28/E:(1,2,3)(8,9)(10,11)(12,13)(14,15)/rA:28nCCCCCCCCCCCONCCCCCCCOCCCCCCO/rB:s1;s2;s2;s2;s5;d6;s7;d8;d5s9;s8;d11;s11;s13;s14;s15;s16;s13s17;s16;s19;d20;s20;s22;d23;s24;d25;d22s26;s16s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C24H27NO3 |
All Atoms: | 55 |
Heavy Atoms: | 28 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 11.2584 |
Area: | 580.817 |
Solvation: | -3.26201 |
Coulombic: | -35.5427 |
Bond Count [?]
All: | 31 |
Single: | 23 |
Double: | 8 |
Rotors: | 3 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 5.11 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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