F7F

3-PYRIDIN-4-YL-2,4-DIHYDRO-INDENO[1,2-.C.]PYRAZOLE

Created:	2020-04-06
Last modified:	2020-07-15

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1 entries where F7F is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	53
Chiral Atom Count	4
Bond Count	56
Aromatic Bond Count	6

2D diagram of F7F

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Chemical Component Summary
Name	3-PYRIDIN-4-YL-2,4-DIHYDRO-INDENO[1,2-.C.]PYRAZOLE
Formula	C₁₇ H₂₁ N₄ O₁₀ P
Molecular Weight	472.343
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	Cc1cc2N(C[CH](O)[CH](O)[CH](O)CO[P](O)(O)=O)C3=NC(=O)NC(=O)[C]34ON4c2cc1C
SMILES	OpenEye OEToolkits	2.0.7	Cc1cc2c(cc1C)N3C4(O3)C(=O)NC(=O)N=C4N2CC(C(C(COP(=O)(O)O)O)O)O
Canonical SMILES	CACTVS	3.385	Cc1cc2N(C[C@@H](O)[C@@H](O)[C@@H](O)CO[P](O)(O)=O)C3=NC(=O)NC(=O)[C@@]34ON4c2cc1C
Canonical SMILES	OpenEye OEToolkits	2.0.7	Cc1cc2c(cc1C)N3[C@@]4(O3)C(=O)NC(=O)N=C4N2C[C@H]([C@H]([C@H](COP(=O)(O)O)O)O)O
InChI	InChI	1.03	InChI=1S/C17H21N4O10P/c1-7-3-9-10(4-8(7)2)21-17(31-21)14(18-16(26)19-15(17)25)20(9)5-11(22)13(24)12(23)6-30-32(27,28)29/h3-4,11-13,22-24H,5-6H2,1-2H3,(H,19,25,26)(H2,27,28,29)/t11-,12+,13-,17+,21+/m1/s1
InChIKey	InChI	1.03	SBINLJVNHAXUDP-YRTJRJKOSA-N

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.