1-Stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine

Catalog Number	ACM6418957
CAS	6418-95-7
Synonyms	PE(18:0/18:1(9Z))
IUPAC Name	2,3-Dichloro-N-[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]benzamide
Molecular Weight	397.2
Molecular Formula	C21H14Cl2N2O2
Canonical SMILES	CC1=CC2=C(C=C1)OC(=N2)C3=CC(=CC=C3)NC(=O)C4=C(C(=CC=C4)Cl)Cl
InChI	InChI=1S/C21H14Cl2N2O2/c1-12-8-9-18-17(10-12)25-21(27-18)13-4-2-5-14(11-13)24-20(26)15-6-3-7-16(22)19(15)23/h2-11H,1H3,(H,24,26)
InChI Key	GKFNHDBVWFEZCJ-UHFFFAOYSA-N
Purity	99%+
Complexity	534
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Exact Mass	396.0432331
Heavy Atom Count	27
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Monoisotopic Mass	396.0432331
Physical State	Powder
Rotatable Bond Count	3
Storage Conditions	-20 °C
Topological Polar Surface Area	55.1 Ų

Knowledge & Learning Case Study Q&A

What is the Canonical SMILES of 1-Stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine?

The Canonical SMILES of 1-Stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine is CCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[NH3+])OC(=O)CCCCCCCC=CCCCCCCCC

What are some of the Depositor-Supplied Synonyms of 1-Stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine?

Some of the Depositor-Supplied Synonyms of 1-Stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine include 1-stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine, 18:0-18:1 PE, and GPE(18:0/18:1).

How many heavy atoms are present in 1-Stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine?

1-Stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine contains 51 heavy atoms.

What is the Molecular Formula of 1-Stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine?

The Molecular Formula of 1-Stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine is C41H80NO8P.

What is the Molecular Weight of 1-Stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine?

The Molecular Weight of 1-Stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine is 746.0g/mol.

What is the Monoisotopic Mass of 1-Stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine?

The Monoisotopic Mass of 1-Stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine is 745.56215551.

How many Covalently-Bonded Units are present in 1-Stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine?

There is 1 Covalently-Bonded Unit in 1-Stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine.

How many Rotatable Bonds are present in 1-Stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine?

1-Stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine has 42 Rotatable Bonds.

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1-Stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine (6418-95-7)

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