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Chemical ID: 7654213

CC(=O)OC1Cc2cc3c(cc2C4C1(c5ccc6c(c5CN4C)OCO6)C)OCO3

Chemical ID:

7654213

Name [?]:

None

SMILES [?]:

CC(=O)OC1Cc2cc3c(cc2C4C1(c5ccc6c(c5CN4C)OCO6)C)OCO3

InChi [?]:

InChI=1/C23H23NO6/c1-12(25)30-20-7-13-6-18-19(28-10-27-18)8-14(13)22-23(20,2)16-4-5-17-21(29-11-26-17)15(16)9-24(22)3/h4-6,8,20,22H,7,9-11H2,1-3H3

InChi Info:

AuxInfo=1/0/N:1,27,23,16,17,8,6,11,21,29,25,2,7,12,20,15,18,9,10,5,19,13,14,22,3,26,30,28,24,4/rA:30cCCOOCCCCCCCCCCCCCCCCCNCOCOCOCO/rB:s1;d2;s2;s4;s5;s6;s7;d8;s9;d10;d7s11;s12;s5s13;s14;s15;d16;s17;d18;d15s19;s20;s13s21;s22;s19;s24;s18s25;s14;s10;s28;s9s29;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₃H₂₃NO₆
All Atoms:	53
Heavy Atoms:	30
Chiral Atoms:	None

ZAP Information [?]

Total:	8.81313
Area:	558.835
Solvation:	-5.15775
Coulombic:	-56.4937

Bond Count [?]

All:	35
Single:	28
Double:	7
Rotors:	2
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	2.93
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