chempirical

Menaquinone 7

C46H64O2CAS 2124-57-4649.02 g/mol

Open in Covalent MOL file
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AlkeneKetone

Properties

Molecular formula
C46H64O2
Molar mass
649.02 g/mol
Exact mass
648.4906 Da
Melting point
54 °C
logP
14.10Crippen estimate
Polar surface area
34.1 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
20
Double bonds
E, E, E, E, E, EE/Z, in SMILES order

Identifiers

CAS number
2124-57-4
SMILES
CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC1=C(C)C(=O)c2ccccc2C1=O
InChIKey
RAKQPZMEYJZGPI-LJWNYQGCSA-N
InChI
InChI=1S/C46H64O2/c1-34(2)18-12-19-35(3)20-13-21-36(4)22-14-23-37(5)24-15-25-38(6)26-16-27-39(7)28-17-29-40(8)32-33-42-41(9)45(47)43-30-10-11-31-44(43)46(42)48/h10-11,18,20,22,24,26,28,30-32H,12-17,19,21,23,25,27,29,33H2,1-9H3/b35-20+,36-22+,37-24+,38-26+,39-28+,40-32+

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

11 names
  • 1,4-Naphthalenedione, 2-[(2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-heptamethyl-2,6,10,14,18,22,26-octacosaheptaen-1-yl]-3-methyl-
  • 1,4-Naphthoquinone, 2-(3,7,11,15,19,23,27-heptamethyl-2,6,10,14,18,22,26-octacosaheptaenyl)-3-methyl-, (all-E)-
  • 1,4-Naphthalenedione, 2-(3,7,11,15,19,23,27-heptamethyl-2,6,10,14,18,22,26-octacosaheptaenyl)-3-methyl-, (all-E)-
  • 1,4-Naphthalenedione, 2-[(2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-heptamethyl-2,6,10,14,18,22,26-octacosaheptaenyl]-3-methyl-
  • 2-[(2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-Heptamethyl-2,6,10,14,18,22,26-octacosaheptaen-1-yl]-3-methyl-1,4-naphthalenedione
  • Vitamin K2(35)
  • Menaquinone K7
  • MK-7
  • Vitamin MK 7
  • K 2 Oil M 1500
  • Vitamin K2-7

Work with Menaquinone 7

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Vitamin K211032-49-8100 % similar Menaquinone 684-81-1100 % similar Menaquinone 4863-61-6100 % similar Vitamin K12001-79-558 % similar Phylloquinone84-80-058 % similar Lapachol84-79-752 % similar Coenzyme Q10303-98-049 % similar Farnesylthiosalicylic acid162520-00-548 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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