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Chemical ID: 7638295
Chemical ID:
7638295
Name [?]:
None
SMILES [?]:
CC12CCC(=O)C=C1CC(C3C24C(O4)CC5(C3CCC56CCC(=O)O6)C)C(=O)OC
InChi [?]:
InChI=1/C24H30O6/c1-21-7-4-14(25)10-13(21)11-15(20(27)28-3)19-16-5-8-23(9-6-18(26)30-23)22(16,2)12-17-24(19,21)29-17/h10,15-17,19H,4-9,11-12H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,26,30,4,18,22,3,19,21,7,9,15,8,5,10,17,13,23,11,27,2,16,20,12,6,24,28,29,14,25/rA:30cCCCCCOCCCCCCCOCCCCCCCCCOOCCOOC/rB:s1;s2;s3;s4;d5;s5;s2d7;s8;s9;s10;s2s11;s12;s12s13;s13;s15;s11s16;s17;s18;s16s19;s20;s21;s22;d23;s20s23;s16;s10;d27;s27;s29;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C24H30O6 |
All Atoms: | 60 |
Heavy Atoms: | 30 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 8.2909 |
Area: | 547.113 |
Solvation: | -5.38693 |
Coulombic: | -51.966 |
Bond Count [?]
All: | 35 |
Single: | 31 |
Double: | 4 |
Rotors: | 2 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 1.28 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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Chemical Mix | Source | External ID | Descriptor | Value |
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