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Molecule Detail Page

Molecule name

Cardiolipin

Additional molecule names

English en
Cardiolypin
CL
Chinese zh
心磷脂

Molecular Structure

Properties calculated from structure

PropertyValue ?
FormulaC13H16*4O17P2
Weight506.207 [g/mol]
Complexity669.43
XLogP-2.98
TPSA242.61
#HDonors1
#HAcceptors17
Gibbs Energy ( -382.2 ) [kcal/mol]
1H NMR spectrum Predict NMR spectrum (requires installed Java plugin)
Predict NMR spectrum (requires HTML5 compatible browser)
13C NMR spectrum Predict NMR spectrum (requires HTML5 compatible browser)
Isotopic distribution Predict Isotopic distribution

Structure representations/Cross-references

PropertyValue ?
SMILES[*H3]C(=O)OC[C@@H](CO[P+]([O-])([O-])OC[C@H](O)CO[P+]([O-])([O-])OC[C@H](COC([*H3])=O)OC([*H3])=O)OC([*H3])=O
InChIInChI=1S/C13H18O17P2/c14-7-23-3-12(25-9-16)5-29-31(19,20)27-1-11(18)2-28-32(21,22)30-6-13(26-10-17)4-24-8-15/h11-13,18H,1-6H2,(H,19,20)(H,21,22)/p-2/t12-,13-/m1/s1
InChI-Key InChIKey=OZAXQCAYRJCVHH-CHWSQXEVSA-L
KEGG ID C05980
ChEBI ID None
PubChem-CID None

Taxonomy

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Most similar molecules

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Reactions the molecule is involved in

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Pathways the molecule is involved in

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