Chemical ID: 3965139

CCCCCC=CCC=CC=CC(CC=CCCCC(=O)O)O
Chemical ID:
3965139
Name [?]:
8-hydroxyicosa-5,9,11,14-tetraenoic acid
SMILES [?]:
CCCCCC=CCC=CC=CC(CC=CCCCC(=O)O)O
InChi [?]:
InChI=1/C20H32O3/c1-2-3-4-5-6-7-8-9-10-13-16-19(21)17-14-11-12-15-18-20(22)23/h6-7,9-11,13-14,16,19,21H,2-5,8,12,15,17-18H2,1H3,(H,22,23)
InChi Info:
AuxInfo=1/1/N:1,2,3,4,5,6,7,8,9,10,16,17,11,15,18,12,14,19,13,20,23,21,22/E:(22,23)/rA:23cCCCCCCCCCCCCCCCCCCCCOOO/rB:s1;s2;s3;s4;s5;w6;s7;s8;w9;s10;w11;s12;s13;s14;w15;s16;s17;s18;s19;d20;s20;s13;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H32O3
All Atoms:23
Heavy Atoms:23
Chiral Atoms:1
ZAP Information [?]
Total:13.4778
Area:666.585
Solvation:-3.18681
Coulombic:-48.7224
Bond Count [?]
All:22
Single:17
Double:5
Rotors:14
Chiral:4
Rigid Segments:9
Chemical Properties
Molecular Weight:320.466
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:4.96
LogP (Chemaxon):5.24

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