(3R,4S,9R)-3-methoxy-4-methyl-tetratriacont-10-yn-9-ol

Systemtic Name: (3R,4S,9R)-3-methoxy-4-methyl-tetratriacont-10-yn-9-ol Openeye Name: (3R,4S,9R)-3-methoxy-4-methyl-tetratriacont-10-yn-9-ol CAS Name: (3R,4S,9R)-3-methoxy-4-methyl-10-tetratriacontyn-9-ol IUPAC Name: (3R,4S,9R)-3-methoxy-4-methyltetratriacont-10-yn-9-ol Traditional Name: (3R,4S,9R)-3-methoxy-4-methyl-tetratriacont-10-yn-9-ol Formula: C36H70O2 MolecularWeight: 534.9398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCC#CC(CCCCC(C)C(CC)OC)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCC#C[C@@H](CCCC[C@H](C)[C@@H](CC)OC)O

InChI

InChI=1S/C36H70O2/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-32-35(37)33-30-29-31-34(3)36(6-2)38-4/h34-37H,5-27,29-31,33H2,1-4H3/t34-,35-,36+/m0/s1