3-pentadecyl-2,2,3-tri(triacontyl)tritriacontanoate

Systemtic Name: 3-pentadecyl-2,2,3-tri(triacontyl)tritriacontanoate Openeye Name: 3-pentadecyl-2,2,3-tri(triacontyl)tritriacontanoate CAS Name: 3-pentadecyl-2,2,3-tri(triacontyl)tritriacontanoate IUPAC Name: 3-pentadecyl-2,2,3-tri(triacontyl)tritriacontanoate Traditional Name: 2,2,3-trimelissyl-3-pentadecyl-ceromelissate Formula: C138H275O2- MolecularWeight: 1966.6589

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCC)(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)C(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCC)(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)C(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)C(=O)[O-]

InChI

InChI=1S/C138H276O2/c1-6-11-16-21-26-31-36-41-45-49-53-57-61-65-69-73-77-81-85-89-93-97-102-107-112-117-122-127-132-137(131-126-121-116-111-106-101-40-35-30-25-20-15-10-5,133-128-123-118-113-108-103-98-94-90-86-82-78-74-70-66-62-58-54-50-46-42-37-32-27-22-17-12-7-2)138(136(139)140,134-129-124-119-114-109-104-99-95-91-87-83-79-75-71-67-63-59-55-51-47-43-38-33-28-23-18-13-8-3)135-130-125-120-115-110-105-100-96-92-88-84-80-76-72-68-64-60-56-52-48-44-39-34-29-24-19-14-9-4/h6-135H2,1-5H3,(H,139,140)/p-1