1-O-hexadecyl-2-hydroxy-sn-glycero-3-phosphate (ammonium salt)

Catalog Number	ACM799279666
CAS	799279-66-6
Synonyms	C16 LPA
IUPAC Name	Azanium;(2S)-1-hexadecoxy-3-phosphonooxypropan-2-olate
Molecular Weight	413.5
Molecular Formula	C19H44NO6P
Canonical SMILES	CCCCCCCCCCCCCCCCOCC(COP(=O)(O)O)[O-].[NH4+]
InChI	InChI=1S/C19H40O6P.H3N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-24-17-19(20)18-25-26(21,22)23;/h19H,2-18H2,1H3,(H2,21,22,23);1H3/q-1;/p+1/t19-;/m0./s1
InChI Key	SYLRGFVSCWCOJC-FYZYNONXSA-O
Purity	99%+
Complexity	334
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Exact Mass	413.29062512
Heavy Atom Count	27
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	3
Isomeric SMILES	CCCCCCCCCCCCCCCCOC[C@@H](COP(=O)(O)O)[O-].[NH4+]
Monoisotopic Mass	413.29062512
Physical State	Powder
Rotatable Bond Count	20
Storage Conditions	-20 °C
Topological Polar Surface Area	100 Ų

Knowledge & Learning Case Study Q&A

What is the molecular formula for 1-O-hexadecyl-2-hydroxy-sn-glycero-3-phosphate (ammonium salt)?

The molecular formula for 1-O-hexadecyl-2-hydroxy-sn-glycero-3-phosphate (ammonium salt) is C19H44NO6P.

What is the exact mass of 1-O-hexadecyl-2-hydroxy-sn-glycero-3-phosphate (ammonium salt)?

The exact mass of 1-O-hexadecyl-2-hydroxy-sn-glycero-3-phosphate (ammonium salt) is 413.29062512.

What is the IUPAC name of 1-O-hexadecyl-2-hydroxy-sn-glycero-3-phosphate (ammonium salt)?

The IUPAC name of 1-O-hexadecyl-2-hydroxy-sn-glycero-3-phosphate (ammonium salt) is azanium;[(2R)-3-hexadecoxy-2-hydroxypropyl] hydrogen phosphate.

How many covalently-bonded units are there in 1-O-hexadecyl-2-hydroxy-sn-glycero-3-phosphate (ammonium salt)?

There are 2 covalently-bonded units in 1-O-hexadecyl-2-hydroxy-sn-glycero-3-phosphate (ammonium salt).

What is the Canonical SMILES representation of 1-O-hexadecyl-2-hydroxy-sn-glycero-3-phosphate (ammonium salt)?

The Canonical SMILES representation of 1-O-hexadecyl-2-hydroxy-sn-glycero-3-phosphate (ammonium salt) is CCCCCCCCCCCCCCCCCOCC(COP(=O)(O)[O-])O.[NH4+].

How many hydrogen bond acceptors are there in 1-O-hexadecyl-2-hydroxy-sn-glycero-3-phosphate (ammonium salt)?

There are 6 hydrogen bond acceptors in 1-O-hexadecyl-2-hydroxy-sn-glycero-3-phosphate (ammonium salt).

What is the topological polar surface area of 1-O-hexadecyl-2-hydroxy-sn-glycero-3-phosphate (ammonium salt)?

The topological polar surface area of 1-O-hexadecyl-2-hydroxy-sn-glycero-3-phosphate (ammonium salt) is 100.

What is the Computed Properties Rotatable Bond Count of 1-O-hexadecyl-2-hydroxy-sn-glycero-3-phosphate (ammonium salt)?

The Computed Properties Rotatable Bond Count of 1-O-hexadecyl-2-hydroxy-sn-glycero-3-phosphate (ammonium salt) is 20.

What is the InChIKey of 1-O-hexadecyl-2-hydroxy-sn-glycero-3-phosphate (ammonium salt)?

The InChIKey of 1-O-hexadecyl-2-hydroxy-sn-glycero-3-phosphate (ammonium salt) is CZAOPXJWCUFSOL-FSRHSHDFSA-N.

What are the Depositor-Supplied Synonyms of 1-O-hexadecyl-2-hydroxy-sn-glycero-3-phosphate (ammonium salt)?

The Depositor-Supplied Synonyms of 1-O-hexadecyl-2-hydroxy-sn-glycero-3-phosphate (ammonium salt) are C16 LPA, 1-O-hexadecyl-2-hydroxy-sn-glycero-3-phosphate (ammonium salt), powder.

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