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Details

Stereochemistry ABSOLUTE
Molecular Formula C58H70N6O31S3.4Na
Molecular Weight 1535.352
Optical Activity UNSPECIFIED
Defined Stereocenters 15 / 15
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RIVIPANSEL SODIUM

SMILES

[Na+].[Na+].[Na+].[Na+].[H][C@@]8(O[C@@H]1[C@H](C[C@H](C[C@H]1O[C@]2([H])O[C@H](CO)[C@H](O)[C@H](O[C@@H](CC3CCCCC3)C([O-])=O)[C@H]2OC(=O)C4=CC=CC=C4)C(=O)NCCNC(=O)COCCOCC(=O)NC5=CC(=CC6=CC(=CC(=C56)S([O-])(=O)=O)S([O-])(=O)=O)S([O-])(=O)=O)NC(=O)C7=CC(=O)NC(=O)N7)O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]8O

InChI

InChIKey=QQDCIMVGFXSAJH-DJFGCAFRSA-J
InChI=1S/C58H74N6O31S3.4Na/c1-27-45(69)47(71)48(72)56(90-27)95-49-35(62-53(74)36-23-41(66)64-58(78)63-36)19-31(20-37(49)92-57-51(94-55(77)29-10-6-3-7-11-29)50(46(70)39(24-65)93-57)91-38(54(75)76)16-28-8-4-2-5-9-28)52(73)60-13-12-59-42(67)25-88-14-15-89-26-43(68)61-34-21-32(96(79,80)81)17-30-18-33(97(82,83)84)22-40(44(30)34)98(85,86)87;;;;/h3,6-7,10-11,17-18,21-23,27-28,31,35,37-39,45-51,56-57,65,69-72H,2,4-5,8-9,12-16,19-20,24-26H2,1H3,(H,59,67)(H,60,73)(H,61,68)(H,62,74)(H,75,76)(H,79,80,81)(H,82,83,84)(H,85,86,87)(H2,63,64,66,78);;;;/q;4*+1/p-4/t27-,31+,35-,37+,38-,39+,45+,46-,47+,48-,49+,50-,51+,56-,57+;;;;/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 C58H70N6O31S3
Molecular Weight 1443.393
Charge -4
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 08:38:02 UTC 2023
Edited
by admin
on Sat Dec 16 08:38:02 UTC 2023
Record UNII
11AEN6VWDN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RIVIPANSEL SODIUM
USAN   WHO-DD  
USAN  
Official Name English
GMI-1070
Code English
PF-06460031-02
Code English
RIVIPANSEL SODIUM [USAN]
Common Name English
PF-0646003102
Code English
Rivipansel sodium [WHO-DD]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C26170
Created by admin on Sat Dec 16 08:38:02 UTC 2023 , Edited by admin on Sat Dec 16 08:38:02 UTC 2023
NCI_THESAURUS C78275
Created by admin on Sat Dec 16 08:38:02 UTC 2023 , Edited by admin on Sat Dec 16 08:38:02 UTC 2023
Code System Code Type Description
ChEMBL
CHEMBL3707446
Created by admin on Sat Dec 16 08:38:02 UTC 2023 , Edited by admin on Sat Dec 16 08:38:02 UTC 2023
PRIMARY
USAN
ZZ-163
Created by admin on Sat Dec 16 08:38:02 UTC 2023 , Edited by admin on Sat Dec 16 08:38:02 UTC 2023
PRIMARY
NCI_THESAURUS
C154445
Created by admin on Sat Dec 16 08:38:02 UTC 2023 , Edited by admin on Sat Dec 16 08:38:02 UTC 2023
PRIMARY
FDA UNII
11AEN6VWDN
Created by admin on Sat Dec 16 08:38:02 UTC 2023 , Edited by admin on Sat Dec 16 08:38:02 UTC 2023
PRIMARY
SMS_ID
300000007300
Created by admin on Sat Dec 16 08:38:02 UTC 2023 , Edited by admin on Sat Dec 16 08:38:02 UTC 2023
PRIMARY
EPA CompTox
DTXSID10152261
Created by admin on Sat Dec 16 08:38:02 UTC 2023 , Edited by admin on Sat Dec 16 08:38:02 UTC 2023
PRIMARY
DRUG BANK
DBSALT002408
Created by admin on Sat Dec 16 08:38:02 UTC 2023 , Edited by admin on Sat Dec 16 08:38:02 UTC 2023
PRIMARY
CAS
1189037-60-2
Created by admin on Sat Dec 16 08:38:02 UTC 2023 , Edited by admin on Sat Dec 16 08:38:02 UTC 2023
PRIMARY
PUBCHEM
44232545
Created by admin on Sat Dec 16 08:38:02 UTC 2023 , Edited by admin on Sat Dec 16 08:38:02 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY