Chemical ID: 6623707

CCOC(=O)C1C2C(C(C1=O)C(=O)OCC)C(C(=O)C2C(=O)OCC)C(=O)OCC
Chemical ID:
6623707
Name [?]:
None
SMILES [?]:
CCOC(=O)C1C2C(C(C1=O)C(=O)OCC)C(C(=O)C2C(=O)OCC)C(=O)OCC
InChi [?]:
InChI=1/C20H26O10/c1-5-27-17(23)11-9-10(13(15(11)21)19(25)29-7-3)14(20(26)30-8-4)16(22)12(9)18(24)28-6-2/h9-14H,5-8H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,25,16,30,2,24,15,29,7,8,6,20,9,17,10,18,4,21,12,26,11,19,5,22,13,27,3,23,14,28/E:(1,2,3,4)(5,6,7,8)(9,10)(11,12,13,14)(15,16)(17,18,19,20)(21,22)(23,24,25,26)(27,28,29,30)/rA:30cCCOCOCCCCCOCOOCCCCOCCOOCCCOOCC/rB:s1;s2;s3;d4;s4;s6;s7;s8;s6s9;d10;s9;d12;s12;s14;s15;s8;s17;d18;s7s18;s20;d21;s21;s23;s24;s17;d26;s26;s28;s29;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H26O10
All Atoms:30
Heavy Atoms:30
Chiral Atoms:4
ZAP Information [?]
Total:7.43347
Area:609.429
Solvation:-7.80227
Coulombic:-78.6678
Bond Count [?]
All:31
Single:25
Double:6
Rotors:12
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:426.414
H-Bond Donors:0
H-Bond Acceptors:10
XLogP:-0.85
LogP (Chemaxon):1.51

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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