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trihenicosan-5-yl phosphate

trihenicosan-5-yl phosphate

Systemtic Name:trihenicosan-5-yl phosphate
Openeye Name:tris(1-butylheptadecyl) phosphate
CAS Name:phosphoric acid triheneicosan-5-yl ester
IUPAC Name:trihenicosan-5-yl phosphate
Traditional Name:phosphoric acid tris(1-butylheptadecyl) ester
Formula: C63H129O4P
MolecularWeight: 981.669721
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(CCCC)OP(=O)(OC(CCCC)CCCCCCCCCCCCCCCC)OC(CCCC)CCCCCCCCCCCCCCCC


Isomeric SMILES

CCCCCCCCCCCCCCCCC(CCCC)OP(=O)(OC(CCCC)CCCCCCCCCCCCCCCC)OC(CCCC)CCCCCCCCCCCCCCCC


InChI

InChI=1S/C63H129O4P/c1-7-13-19-22-25-28-31-34-37-40-43-46-49-52-58-61(55-16-10-4)65-68(64,66-62(56-17-11-5)59-53-50-47-44-41-38-35-32-29-26-23-20-14-8-2)67-63(57-18-12-6)60-54-51-48-45-42-39-36-33-30-27-24-21-15-9-3/h61-63H,7-60H2,1-6H3


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