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2-methyl-14,15,17,19-tetrakis(oxidanyl)hentetracontan-18-one

2-methyl-14,15,17,19-tetrakis(oxidanyl)hentetracontan-18-one

Systemtic Name:2-methyl-14,15,17,19-tetrakis(oxidanyl)hentetracontan-18-one
Openeye Name:14,15,17,19-tetrahydroxy-2-methyl-hentetracontan-18-one
CAS Name:14,15,17,19-tetrahydroxy-2-methyl-18-hentetracontanone
IUPAC Name:14,15,17,19-tetrahydroxy-2-methylhentetracontan-18-one
Traditional Name:14,15,17,19-tetrahydroxy-2-methyl-hentetracontan-18-one
Formula: C42H84O5
MolecularWeight: 669.11336
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCC(C(=O)C(CC(C(CCCCCCCCCCCC(C)C)O)O)O)O


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCC(C(=O)C(CC(C(CCCCCCCCCCCC(C)C)O)O)O)O


InChI

InChI=1S/C42H84O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-26-29-32-35-39(44)42(47)41(46)36-40(45)38(43)34-31-28-25-23-20-21-24-27-30-33-37(2)3/h37-41,43-46H,4-36H2,1-3H3


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