Chemical ID: 7654470

CC12CCCC3(C1C(OC2)O)COC(=O)C45C3CCC(C4)C(=C)C5=O
Chemical ID:
7654470
Name [?]:
None
SMILES [?]:
CC12CCCC3(C1C(OC2)O)COC(=O)C45C3CCC(C4)C(=C)C5=O
InChi [?]:
InChI=1/C20H26O5/c1-11-12-4-5-13-19(10-25-17(23)20(13,8-12)15(11)21)7-3-6-18(2)9-24-16(22)14(18)19/h12-14,16,22H,1,3-10H2,2H3
InChi Info:
AuxInfo=1/0/N:23,1,4,19,18,3,5,21,10,12,22,20,17,7,24,8,14,2,6,16,25,11,15,9,13/rA:25cCCCCCCCCOCOCOCOCCCCCCCCCO/rB:s1;s2;s3;s4;s5;s2s6;s7;s8;s2s9;s8;s6;s12;s13;d14;s14;s6s16;s17;s18;s19;s16s20;s20;d22;s16s22;d24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H26O5
All Atoms:51
Heavy Atoms:25
Chiral Atoms:None
ZAP Information [?]
Total:5.93841
Area:462.287
Solvation:-5.61877
Coulombic:-51.2184
Bond Count [?]
All:29
Single:26
Double:3
Rotors:0
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:2.18
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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