Lipids

Cas#: 30414-54-1        Compound CID:  121700

Formula:  C₇H₁₂O₃        Molecular Weight: 144.17

IUPAC Name: methyl 3-oxohexanoate

SMILES: CCCC(=O)CC(=O)OC

InChIKey: SJPCQNABHNCLPB-UHFFFAOYSA-N

InChI: InChI=1S/C7H12O3/c1-3-4-6(8)5-7(9)10-2/h3-5H2,1-2H3

Cas#: 124-25-4        Compound CID:  31291

Formula:  C₁₄H₂₈O        Molecular Weight: 212.38

IUPAC Name: tetradecanal

SMILES: CCCCCCCCCCCCCC=O

InChIKey: UHUFTBALEZWWIH-UHFFFAOYSA-N

InChI: InChI=1S/C14H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h14H,2-13H2,1H3

Cas#: 18281-04-4        Compound CID:  29008

Formula:  C₂₁H₄₂O₂        Molecular Weight: 326.57

IUPAC Name: ethyl nonadecanoate

SMILES: CCCCCCCCCCCCCCCCCCC(=O)OCC

InChIKey: ICVYQLQYVCXJNE-UHFFFAOYSA-N

InChI: InChI=1S/C21H42O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-4-2/h3-20H2,1-2H3

Cas#: 37811-72-6        Compound CID:  101338

Formula:  C₁₆H₃₂O₂        Molecular Weight: 256.43

IUPAC Name: 2-methylpropyl dodecanoate

SMILES: CCCCCCCCCCCC(=O)OCC(C)C

InChIKey: SZFOMJOELAAHAF-UHFFFAOYSA-N

InChI: InChI=1S/C16H32O2/c1-4-5-6-7-8-9-10-11-12-13-16(17)18-14-15(2)3/h15H,4-14H2,1-3H3

Cas#: 2311-59-3        Compound CID:  16833

Formula:  C₁₃H₂₆O₂        Molecular Weight: 214.35

IUPAC Name: propan-2-yl decanoate

SMILES: CCCCCCCCCC(=O)OC(C)C

InChIKey: PKPPDYGHKDIKBH-UHFFFAOYSA-N

InChI: InChI=1S/C13H26O2/c1-4-5-6-7-8-9-10-11-13(14)15-12(2)3/h12H,4-11H2,1-3H3

Cas#: 539-93-5        Compound CID:  101758

Formula:  C₂₇H₅₂O₅        Molecular Weight: 456.7

IUPAC Name: (3-dodecanoyloxy-2-hydroxypropyl) dodecanoate

SMILES: CCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCC)O

InChIKey: KUVAEMGNHJQSMH-UHFFFAOYSA-N

InChI: InChI=1S/C27H52O5/c1-3-5-7-9-11-13-15-17-19-21-26(29)31-23-25(28)24-32-27(30)22-20-18-16-14-12-10-8-6-4-2/h25,28H,3-24H2,1-2H3

Cas#: 18485-38-6        Compound CID:  6436491

Formula:  C₁₂H₂₂O        Molecular Weight: 182.31

IUPAC Name: (2E,4E)-dodeca-2,4-dien-1-ol

SMILES: CCCCCCCC=CC=CCO

InChIKey: RZDDYVXRTNDWOD-BNFZFUHLSA-N

InChI: InChI=1S/C12H22O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h8-11,13H,2-7,12H2,1H3/b9-8+,11-10+

Cas#: 86227-47-6        Compound CID:  9831415

Formula:  C₂₂H₃₄O₂        Molecular Weight: 330.51

IUPAC Name: ethyl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate

SMILES: CCC=CCC=CCC=CCC=CCC=CCCCC(=O)OCC

InChIKey: SSQPWTVBQMWLSZ-AAQCHOMXSA-N

InChI: InChI=1S/C22H34O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24-4-2/h5-6,8-9,11-12,14-15,17-18H,3-4,7,10,13,16,19-21H2,1-2H3/b6-5-,9-8-,12-11-,15-14-,18-17-

Cas#: 33467-76-4        Compound CID:  5318017

Formula:  C₇H₁₄O        Molecular Weight: 114.19

IUPAC Name: (E)-hept-2-en-1-ol

SMILES: CCCCC=CCO

InChIKey: ASFYPVGAALGVNR-AATRIKPKSA-N

InChI: InChI=1S/C7H14O/c1-2-3-4-5-6-7-8/h5-6,8H,2-4,7H2,1H3/b6-5+

Cas#: 54397-84-1        Compound CID:  5283141

Formula:  C₁₇H₂₈O₃        Molecular Weight: 280.4

IUPAC Name: (5Z,8E,10E,12S)-12-hydroxyheptadeca-5,8,10-trienoic acid

SMILES: CCCCCC(C=CC=CCC=CCCCC(=O)O)O

InChIKey: KUKJHGXXZWHSBG-WBGSEQOASA-N

InChI: InChI=1S/C17H28O3/c1-2-3-10-13-16(18)14-11-8-6-4-5-7-9-12-15-17(19)20/h5-8,11,14,16,18H,2-4,9-10,12-13,15H2,1H3,(H,19,20)/b7-5-,8-6+,14-11+/t16-/m0/s1