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

Systemtic Name: 2,2,3-tri(triacontyl)-3-tridecyl-tritriacontanoate Openeye Name: 2,2,3-tri(triacontyl)-3-tridecyl-tritriacontanoate CAS Name: 2,2,3-tri(triacontyl)-3-tridecyltritriacontanoate IUPAC Name: 2,2,3-tri(triacontyl)-3-tridecyltritriacontanoate Traditional Name: 2,2,3-trimelissyl-3-tridecyl-ceromelissate Formula: C136H271O2- MolecularWeight: 1938.60574

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C136H272O2/c1-6-11-16-21-26-31-36-40-44-48-52-56-60-64-68-72-76-80-84-88-92-96-100-105-110-115-120-125-130-135(129-124-119-114-109-104-35-30-25-20-15-10-5,131-126-121-116-111-106-101-97-93-89-85-81-77-73-69-65-61-57-53-49-45-41-37-32-27-22-17-12-7-2)136(134(137)138,132-127-122-117-112-107-102-98-94-90-86-82-78-74-70-66-62-58-54-50-46-42-38-33-28-23-18-13-8-3)133-128-123-118-113-108-103-99-95-91-87-83-79-75-71-67-63-59-55-51-47-43-39-34-29-24-19-14-9-4/h6-133H2,1-5H3,(H,137,138)/p-1