Chemical ID: 6634299

CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC5=O)C)C)C2C1)C)C)C
Chemical ID:
6634299
Name [?]:
None
SMILES [?]:
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC5=O)C)C)C2C1)C)C)C
InChi [?]:
InChI=1/C27H42O/c1-23(2)13-14-24(3)15-16-26(5)18(20(24)17-23)7-8-22-25(4)11-10-21(28)19(25)9-12-27(22,26)6/h7,19-20,22H,8-17H2,1-6H3
InChi Info:
AuxInfo=1/0/N:1,28,27,22,26,23,10,11,15,19,18,14,3,4,6,7,25,9,16,24,20,12,2,5,17,8,13,21/E:(1,2)/rA:28cCCCCCCCCCCCCCCCCCCCCOCCCCCCC/rB:s1;s2;s3;s4;s5;s6;s7;s8;d9;s10;s11;s8s12;s13;s14;s15;s12s16;s17;s18;s16s19;d20;s17;s13;s5s9;s2s24;s8;s5;s2;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C27H42O
All Atoms:28
Heavy Atoms:28
Chiral Atoms:7
ZAP Information [?]
Total:11.9287
Area:543.463
Solvation:-1.65783
Coulombic:-11.359
Bond Count [?]
All:32
Single:30
Double:2
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:382.622
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:7.34
LogP (Chemaxon):7.22

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Descriptor Annotations

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