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Chemical ID: 7598317
Chemical ID:
7598317
Name [?]:
None
SMILES [?]:
CC12CCC(=O)C=C1C3CC3C4C2CCC5(C4C6CC6C57CCC(=O)O7)C
InChi [?]:
InChI=1/C24H30O3/c1-22-6-3-12(25)9-17(22)13-10-14(13)20-16(22)4-7-23(2)21(20)15-11-18(15)24(23)8-5-19(26)27-24/h9,13-16,18,20-21H,3-8,10-11H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,27,4,14,23,3,15,22,7,10,19,5,9,11,18,13,8,20,24,12,17,2,16,21,6,25,26/rA:27cCCCCCOCCCCCCCCCCCCCCCCCCOOC/rB:s1;s2;s3;s4;d5;s5;s2d7;s8;s9;s9s10;s11;s2s12;s13;s14;s15;s12s16;s17;s18;s18s19;s16s20;s21;s22;s23;d24;s21s24;s16;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C24H30O3 |
All Atoms: | 57 |
Heavy Atoms: | 27 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 9.28399 |
Area: | 521.449 |
Solvation: | -3.75223 |
Coulombic: | -26.186 |
Bond Count [?]
All: | 33 |
Single: | 30 |
Double: | 3 |
Rotors: | 0 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 4.31 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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