Lipid A 406

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C68H130N2O23P2
Molecular Weight	1405.7069
Optical Activity	UNSPECIFIED
Defined Stereocenters	14 / 14
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCCCCCCCCC[C@@H](O)CC(=O)N[C@H]1[C@@H](OP(O)(O)=O)O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](OP(O)(O)=O)[C@H](OC(=O)C[C@H](O)CCCCCCCCCCC)[C@H]2NC(=O)C[C@H](O)CCCCCCCCCCC)[C@@H](O)[C@@H]1OC(=O)C[C@H](O)CCCCCCCCCCC

InChI

InChIKey=KVJWZTLXIROHIL-QDORLFPLSA-N

InChI=1S/C68H130N2O23P2/c1-5-9-13-17-21-25-29-33-37-41-51(72)45-57(76)69-61-65(90-59(78)47-53(74)43-39-35-31-27-23-19-15-11-7-3)63(80)56(89-68(61)93-95(84,85)86)50-87-67-62(70-58(77)46-52(73)42-38-34-30-26-22-18-14-10-6-2)66(64(55(49-71)88-67)92-94(81,82)83)91-60(79)48-54(75)44-40-36-32-28-24-20-16-12-8-4/h51-56,61-68,71-75,80H,5-50H2,1-4H3,(H,69,76)(H,70,77)(H2,81,82,83)(H2,84,85,86)/t51-,52-,53-,54-,55-,56-,61-,62-,63-,64-,65-,66-,67-,68-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C68H130N2O23P2
Molecular Weight	1405.7069
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	14 / 14
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 21:13:57 GMT 2025` Edited by `admin` on `Wed Apr 02 21:13:57 GMT 2025`
Record UNII	4P9U7Y4A4J
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Glycophospholipids, lipid IV A

Preferred Name

English

Lipid A 406

Common Name

English

Lipid IV<sup>A</sup>

Common Name

English

?-D-Glucopyranose, 2-deoxy-6-O-[2-deoxy-3-O-(3-hydroxy-1-oxotetradecyl)-2-[(3-hydroxy-1-oxotetradecyl)amino]-4-O-phosphono-?-D-glucopyranosyl]-2-[(3-hydroxy-1-oxotetradecyl)amino]-, 1-(dihydrogen phosphate) 3-(3-hydroxytetradecanoate), [2(R),3(R),6[2(R),

Systematic Name

English

?-D-Glucopyranose, 2-deoxy-6-O-[2-deoxy-3-O-[(3R)-3-hydroxy-1-oxotetradecyl]-2-[[(3R)-3-hydroxy-1-oxotetradecyl]amino]-4-O-phosphono-?-D-glucopyranosyl]-2-[[(3R)-3-hydroxy-1-oxotetradecyl]amino]-, 1-(dihydrogen phosphate) 3-[(3R)-3-hydroxytetradecanoate]

Systematic Name

English

Code System Code Type Description

CAS

91841-27-9

Created by admin on Wed Apr 02 21:13:57 GMT 2025 , Edited by admin on Wed Apr 02 21:13:57 GMT 2025

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PUBCHEM

10329124

Created by admin on Wed Apr 02 21:13:57 GMT 2025 , Edited by admin on Wed Apr 02 21:13:57 GMT 2025

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FDA UNII

4P9U7Y4A4J

Created by admin on Wed Apr 02 21:13:57 GMT 2025 , Edited by admin on Wed Apr 02 21:13:57 GMT 2025

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