ERITORAN TETRASODIUM

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C66H122N2O19P2.4Na
Molecular Weight	1401.5835
Optical Activity	UNSPECIFIED
Defined Stereocenters	11 / 11
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].[Na+].[Na+].[Na+].CCCCCCCCCCCC(=O)CC(=O)N[C@H]1[C@@H](OP([O-])([O-])=O)O[C@H](CO[C@@H]2O[C@H](COC)[C@@H](OP([O-])([O-])=O)[C@H](OCC[C@@H](CCCCCCC)OC)[C@H]2NC(=O)CCCCCCCCC\C=C/CCCCCC)[C@@H](O)[C@@H]1OCCCCCCCCCC

InChI

InChIKey=FEMINZOAAWPBPP-RHMAUSBNSA-J

InChI=1S/C66H126N2O19P2.4Na/c1-7-11-15-19-22-25-26-27-28-29-30-32-34-38-42-46-57(70)67-60-64(82-49-47-54(80-6)45-41-36-18-14-10-4)62(86-88(73,74)75)56(51-79-5)85-65(60)83-52-55-61(72)63(81-48-43-39-35-24-21-17-13-9-3)59(66(84-55)87-89(76,77)78)68-58(71)50-53(69)44-40-37-33-31-23-20-16-12-8-2;;;;/h25-26,54-56,59-66,72H,7-24,27-52H2,1-6H3,(H,67,70)(H,68,71)(H2,73,74,75)(H2,76,77,78);;;;/q;4*+1/p-4/b26-25-;;;;/t54-,55-,56-,59-,60-,61-,62-,63-,64-,65-,66-;;;;/m1..../s1

HIDE SMILES / InChI

Molecular Formula	C66H122N2O19P2
Molecular Weight	1309.6244
Charge	-4
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	11 / 11
E/Z Centers	1
Optical Activity	UNSPECIFIED

Molecular Formula	Na
Molecular Weight	22.9898
Charge	1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:07:02 UTC 2023` Edited by `admin` on `Fri Dec 15 16:07:02 UTC 2023`
Record UNII	FUO195TC7O
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ERITORAN TETRASODIUM

Official Name

English

ERITORAN TETRASODIUM [USAN]

Common Name

English

E5564

Code

English

Eritoran tetrasodium [WHO-DD]

Common Name

English

B-1287

Code

English

ERITORAN TETRASODIUM SALT

Common Name

English

3-O-DECYL-2-DEOXY-6-O-(2-DEOXY-3-O-((3R)-3-METHOXYDECYL)-6-O-METHYL-2-((11Z)-OCTADEC-11-ENOYLAMINO)-4-O-PHOSPHONATO-.BETA.-D-GLUCOPYRANOSYL)-2-((3-OXOTETRADECANOYL)AMINO)-.ALPHA.-D-GLUCOPYRANOSYL TETRASODIUM PHOSPHATE

Common Name

English

ERITORAN TETRASODIUM SALT [MI]

Common Name

English

ERITORAN SODIUM [JAN]

Common Name

English

B1287

Code

English

E-5564

Code

English

.ALPHA.-D-GLUCOPYRANOSE, 3-O-DECYL-2-DEOXY-6-O-(2-DEOXY-3-O-((3R)-3-METHOXYDECYL)-6-O-METHYL-2-(((11Z)-1-OXO-11-OCTADECENYL)AMINO)-4-O-PHOSPHONO-.BETA.-D-GLUCOPYRANOSYL)-2-((1,3-DIOXOTETRADECYL)AMINO)-, 1-(DIHYDROGEN PHOSPHATE), TETRASODIUM SALT

Common Name

English

ERITORAN SODIUM

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C308