3J2

Nagilactone C

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Chemical Component Summary
Name	Nagilactone C
Identifiers	n/a
Formula	C₁₉ H₂₂ O₇
Molecular Weight	362.374
Type	NON-POLYMER
Isomeric SMILES	CC(C)C1=C2[C@H]([C@@H]3[C@H]4[C@]([C@H]([C@@H]5[C@H]([C@@]4(C2=CC(=O)O1)C)O5)O)(C(=O)O3)C)O
InChI	InChI=1S/C19H22O7/c1-6(2)11-9-7(5-8(20)24-11)18(3)14-12(10(9)21)26-17(23)19(14,4)15(22)13-16(18)25-13/h5-6,10,12-16,21-22H,1-4H3/t10-,12-,13-,14-,15+,16-,18-,19-/m1/s1
InChIKey	DGNOPGIIPQKNHD-RSKPZANQSA-N

Chemical Details
Formal Charge	0
Atom Count	48
Chiral Atom Count	8
Bond Count	52
Aromatic Bond Count	0

Related Resource References

Resource Name	Reference
PubChem	72505
ChEMBL	CHEMBL487996

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 R01GM133198.