(S) -VB 201

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Description

(S) -VB 201 is the S-enantiomer of VB 201.VB 201 oxidizes lipid compounds, has anti-inflammatory activity, and can be used for inflammation caused by coronavirus infection.

CAS Number

936227-77-9

Stability

≥ 2 years

Purity

>98% (HPLC)

Weight

581.76

Molecular Formula

C29H60NO8P

Notes

Research use only, not for human use.

Receptor

Others

Chemical Information

(S)-2-(4-Carboxybutoxy)-3-(hexadecyloxy)propyl (2-(trimethylammonio)ethyl) phosphate

CAS Number	936227-77-9
PubChem CID	87331339
IUPAC Name	[(2S)-2-(4-carboxybutoxy)-3-hexadecoxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Molecular Formula	C29H60NO8P
Molecular Weight	581.8
XLogP	6.7
Topological Polar Surface Area	114
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	30
Heavy Atom Count	39
Formal Charge	0
Complexity	606

SMILES

CCCCCCCCCCCCCCCCOC[C@@H](COP(=O)([O-])OCC[N+](C)(C)C)OCCCCC(=O)O

InChI

InChI=1S/C29H60NO8P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-19-23-35-26-28(36-24-20-18-21-29(31)32)27-38-39(33,34)37-25-22-30(2,3)4/h28H,5-27H2,1-4H3,(H-,31,32,33,34)/t28-/m0/s1

InChIKey

JGGNOCUEWOGWPL-NDEPHWFRSA-N

Chemical Structure

2D Structure

CAS: 936227-77-9

CID: 87331339

Formula: C29H60NO8P

MW: 581.8

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	581.8
XLogP3	6.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	30
Exact Mass	581.40565487
Monoisotopic Mass	581.40565487
Topological Polar Surface Area	114 Å²
Heavy Atom Count	39
Formal Charge	0
Complexity	606
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Related Products

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M34467-01	VB 201
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M21167-01	TCN-201
M13299-01	SEL-201
M11977-01	RUSKI-201
M12297-01	BSI-201
M11927-01	HDM-201

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(S) -VB 201

Chemical Information

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