All-trans-heptaprenyl diphosphate

Base Information

• Chemical Name: All-trans-heptaprenyl diphosphate
• CAS No.: 76078-18-7
• Molecular Formula: C35H60O7P2
• Metabolomics Workbench ID: 29127
• Nikkaji Number: J1.002.608C
• Wikidata: Q27102478,Q27123935

Synonyms:all-trans-heptaprenyl diphosphate;heptaprenyl diphosphate;76078-18-7;(2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaen-1-yl trihydrogen diphosphate;[(2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaenyl] phosphono hydrogen phosphate;(E)-heptaprenyl diphosphate;CHEBI:17613;CHEBI:53046;LMPR03030006;C04216;Q27102478;Q27123935;3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaen-1-yl trihydrogen diphosphate

Chemical Property of All-trans-heptaprenyl diphosphate

Chemical Property:

• XLogP3: 10
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 23
• Exact Mass: 654.38142824
• Heavy Atom Count: 44
• Complexity: 1160

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• Canonical SMILES: CC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCOP(=O)(O)OP(=O)(O)O)C)C)C)C)C)C)C
• Isomeric SMILES: CC(=CCC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/COP(=O)(O)OP(=O)(O)O)/C)/C)/C)/C)/C)/C)C

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