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Chemical ID: 7579219
Chemical ID:
7579219
Name [?]:
None
SMILES [?]:
CC(C)C1(CCN2CC3c4ccccc4CCc5c3c(ccc5)C2C1)O
InChi [?]:
InChI=1/C24H29NO/c1-16(2)24(26)12-13-25-15-21-19-8-4-3-6-17(19)10-11-18-7-5-9-20(23(18)21)22(25)14-24/h3-9,16,21-22,26H,10-15H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,3,13,12,22,14,23,11,21,16,17,5,6,25,8,2,15,18,10,20,9,24,19,4,7,26/E:(1,2)/rA:26cCCCCCCNCCCCCCCCCCCCCCCCCCO/rB:s1;s2;s2;s4;s5;s6;s7;s8;s9;s10;d11;s12;d13;d10s14;s15;s16;s17;s9s18;d19;s20;d21;d18s22;s7s20;s4s24;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C24H29NO |
All Atoms: | 55 |
Heavy Atoms: | 26 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 10.0558 |
Area: | 515.652 |
Solvation: | -2.83554 |
Coulombic: | -24.5886 |
Bond Count [?]
All: | 30 |
Single: | 24 |
Double: | 6 |
Rotors: | 1 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 4.44 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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