(3S,4R,5R)-3-icos-19-en-11-ynyl-5-methyl-4-oxidanyl-oxolan-2-one; (3S,4R,5R)-3-icos-11-ynyl-5-methyl-4-oxidanyl-oxolan-2-one

Systemtic Name: (3S,4R,5R)-3-icos-19-en-11-ynyl-5-methyl-4-oxidanyl-oxolan-2-one; (3S,4R,5R)-3-icos-11-ynyl-5-methyl-4-oxidanyl-oxolan-2-one Openeye Name: (3S,4R,5R)-4-hydroxy-3-icos-19-en-11-ynyl-5-methyl-tetrahydrofuran-2-one; (3S,4R,5R)-4-hydroxy-3-icos-11-ynyl-5-methyl-tetrahydrofuran-2-one CAS Name: (3S,4R,5R)-3-eicos-19-en-11-ynyl-4-hydroxy-5-methyl-2-oxolanone; (3S,4R,5R)-3-eicos-11-ynyl-4-hydroxy-5-methyl-2-oxolanone IUPAC Name: (3S,4R,5R)-4-hydroxy-3-icos-19-en-11-ynyl-5-methyloxolan-2-one; (3S,4R,5R)-4-hydroxy-3-icos-11-ynyl-5-methyloxolan-2-one Traditional Name: (3S,4R,5R)-3-eicos-19-en-11-ynyl-4-hydroxy-5-methyl-tetrahydrofuran-2-one; (3S,4R,5R)-3-eicos-11-ynyl-4-hydroxy-5-methyl-tetrahydrofuran-2-one Formula: C50H86O6 MolecularWeight: 783.21424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC#CCCCCCCCCCCC1C(C(OC1=O)C)O.CC1C(C(C(=O)O1)CCCCCCCCCCC#CCCCCCCC=C)O

Isomeric SMILES

CCCCCCCCC#CCCCCCCCCCC[C@H]1[C@H]([C@H](OC1=O)C)O.C[C@@H]1[C@@H]([C@@H](C(=O)O1)CCCCCCCCCCC#CCCCCCCC=C)O

InChI

InChI=1S/C25H44O3.C25H42O3/c2*1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-24(26)22(2)28-25(23)27/h22-24,26H,3-9,12-21H2,1-2H3;3,22-24,26H,1,4-9,12-21H2,2H3/t2*22-,23+,24+/m11/s1