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Chemical ID: 7682321

CC12CCC3C(C1CCC2OC(=O)c4ccccc4)CC=C5C3(CCC(C5)OC(=O)c6ccccc6)C

Chemical ID:

7682321

Name [?]:

None

SMILES [?]:

CC12CCC3C(C1CCC2OC(=O)c4ccccc4)CC=C5C3(CCC(C5)OC(=O)c6ccccc6)C

InChi [?]:

InChI=1/C33H38O4/c1-32-19-17-25(36-30(34)22-9-5-3-6-10-22)21-24(32)13-14-26-27-15-16-29(33(27,2)20-18-28(26)32)37-31(35)23-11-7-4-8-12-23/h3-13,25-29H,14-21H2,1-2H3

InChi Info:

AuxInfo=1/0/N:37,1,34,17,33,35,16,18,32,36,15,19,21,20,8,9,25,4,24,3,27,31,14,22,26,6,7,5,10,29,12,23,2,30,13,28,11/E:(5,6)(7,8)(9,10)(11,12)/rA:37cCCCCCCCCCCOCOCCCCCCCCCCCCCCOCOCCCCCCC/rB:s1;s2;s3;s4;s5;s2s6;s7;s8;s2s9;s10;s11;d12;s12;s14;d15;s16;d17;d14s18;s6;s20;d21;s5s22;s23;s24;s25;s22s26;s26;s28;d29;s29;s31;d32;s33;d34;d31s35;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₃₃H₃₈O₄
All Atoms:	75
Heavy Atoms:	37
Chiral Atoms:	None

ZAP Information [?]

Total:	16.0058
Area:	731.74
Solvation:	-2.28767
Coulombic:	-46.7029

Bond Count [?]

All:	42
Single:	33
Double:	9
Rotors:	6
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	8.56
LogP (Chemaxon):	None

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical Mix	Source	External ID	Descriptor	Value

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical Mix	Source	External ID	Descriptor	Value