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Substance Name: Nickel lapachol
RN: 127796-52-5
InChIKey: NERRQVGLQBFUCC-UHFFFAOYSA-L

Molecular Formula

  • C30-H26-Ni-O6

Molecular Weight

  • 541.2224
 
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Names and Synonyms

Name of Substance

  • Nickel lapachol

Systematic Name

  • Lapachol, Ni deriv.

Registry Numbers

CAS Registry Number

  • 127796-52-5

System Generated Number

  • 0127796525

Structure Descriptors

InChI

1S/2C15H14O3.Ni/c2*1-9(2)7-8-12-13(16)10-5-3-4-6-11(10)14(17)15(12)18;/h2*3-7,18H,8H2,1-2H3;/q;;+2/p-2

InChIKey

NERRQVGLQBFUCC-UHFFFAOYSA-L

Smiles

CC(=CCC1=C(C(=O)c2ccccc2C1=O)[O-])C.CC(=CCC1=C(C(=O)c2ccccc2C1=O)[O-])C.[Ni+2]