UPROLESELAN SODIUM

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C60H108N3O27.Na
Molecular Weight	1326.4932
Optical Activity	UNSPECIFIED
Defined Stereocenters	15 / 15
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].CC[C@H]1C[C@H](C[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O[C@@H](CC3CCCCC3)C([O-])=O)[C@H]2NC(C)=O)[C@@H]1O[C@@H]4O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]4O)C(=O)NCCNC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC

InChI

InChIKey=PXEZBPFEQYCSGD-CVDXTIKBSA-M

InChI=1S/C60H109N3O27.Na/c1-5-44-38-45(39-46(55(44)90-60-54(70)53(69)51(67)41(2)86-60)88-59-50(63-42(3)65)56(52(68)48(40-64)89-59)87-47(58(72)73)37-43-9-7-6-8-10-43)57(71)62-13-12-61-49(66)11-14-75-17-18-77-21-22-79-25-26-81-29-30-83-33-34-85-36-35-84-32-31-82-28-27-80-24-23-78-20-19-76-16-15-74-4;/h41,43-48,50-56,59-60,64,67-70H,5-40H2,1-4H3,(H,61,66)(H,62,71)(H,63,65)(H,72,73);/q;+1/p-1/t41-,44-,45+,46+,47-,48+,50+,51+,52-,53+,54-,55+,56+,59+,60-;/m0./s1

HIDE SMILES / InChI

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

Molecular Formula	C60H108N3O27
Molecular Weight	1303.5034
Charge	-1
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	15 / 15
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:40:46 GMT 2023` Edited by `admin` on `Sat Dec 16 09:40:46 GMT 2023`
Record UNII	17ZJN0Q4CJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

UPROLESELAN SODIUM

Official Name

English

GMI-1271

Code

English

ABI701

Code

English

GMI-1271 SODIUM

Code

English

E-SELECTIN ANTAGONIST GMI-1271

Common Name

English

ABI-701

Code

English

UPROLESELAN SODIUM [USAN]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C29750