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Details

Stereochemistry ABSOLUTE
Molecular Formula C38H64O49S7
Molecular Weight 1529.34
Optical Activity UNSPECIFIED
Defined Stereocenters 25 / 25
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IDRAPARINUX

SMILES

[H][C@]5(O[C@H]1[C@H](OC)[C@@H](OC)[C@]([H])(O[C@@H]2[C@@H](COS(O)(=O)=O)O[C@]([H])(O[C@H]3[C@H](OC)[C@@H](OC)[C@]([H])(O[C@@H]4[C@@H](COS(O)(=O)=O)O[C@H](OC)[C@H](OS(O)(=O)=O)[C@H]4OS(O)(=O)=O)O[C@H]3C(O)=O)[C@H](OS(O)(=O)=O)[C@H]2OS(O)(=O)=O)O[C@@H]1C(O)=O)O[C@H](COS(O)(=O)=O)[C@@H](OC)[C@H](OC)[C@H]5OC

InChI

InChIKey=AJBMORBNKXNZSF-COSHMZDQSA-N
InChI=1S/C38H64O49S7/c1-64-15-12(9-72-88(43,44)45)76-35(27(68-5)18(15)65-2)80-21-19(66-3)28(69-6)37(82-25(21)32(39)40)79-17-14(11-74-90(49,50)51)77-38(31(87-94(61,62)63)24(17)85-92(55,56)57)81-22-20(67-4)29(70-7)36(83-26(22)33(41)42)78-16-13(10-73-89(46,47)48)75-34(71-8)30(86-93(58,59)60)23(16)84-91(52,53)54/h12-31,34-38H,9-11H2,1-8H3,(H,39,40)(H,41,42)(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60)(H,61,62,63)/t12-,13-,14-,15-,16-,17-,18+,19+,20+,21+,22+,23+,24+,25+,26-,27-,28-,29-,30-,31-,34+,35-,36-,37-,38-/m1/s1

HIDE SMILES / InChI

Molecular Formula C38H64O49S7
Molecular Weight 1529.34
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 25 / 25
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 21:31:57 UTC 2023
Edited
by admin
on Fri Dec 15 21:31:57 UTC 2023
Record UNII
6ADD3H8MFZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
IDRAPARINUX
MI   WHO-DD  
Common Name English
SR34006
Code English
SR-34006
Code English
IDRAPARINUX [MI]
Common Name English
Idraparinux [WHO-DD]
Common Name English
Code System Code Type Description
WIKIPEDIA
IDRAPARINUX
Created by admin on Fri Dec 15 21:31:57 UTC 2023 , Edited by admin on Fri Dec 15 21:31:57 UTC 2023
PRIMARY
SMS_ID
100000092150
Created by admin on Fri Dec 15 21:31:57 UTC 2023 , Edited by admin on Fri Dec 15 21:31:57 UTC 2023
PRIMARY
FDA UNII
6ADD3H8MFZ
Created by admin on Fri Dec 15 21:31:57 UTC 2023 , Edited by admin on Fri Dec 15 21:31:57 UTC 2023
PRIMARY
CAS
162610-17-5
Created by admin on Fri Dec 15 21:31:57 UTC 2023 , Edited by admin on Fri Dec 15 21:31:57 UTC 2023
PRIMARY
MESH
C479958
Created by admin on Fri Dec 15 21:31:57 UTC 2023 , Edited by admin on Fri Dec 15 21:31:57 UTC 2023
PRIMARY
EPA CompTox
DTXSID801027578
Created by admin on Fri Dec 15 21:31:57 UTC 2023 , Edited by admin on Fri Dec 15 21:31:57 UTC 2023
PRIMARY
DRUG BANK
DB06406
Created by admin on Fri Dec 15 21:31:57 UTC 2023 , Edited by admin on Fri Dec 15 21:31:57 UTC 2023
PRIMARY
PUBCHEM
3083445
Created by admin on Fri Dec 15 21:31:57 UTC 2023 , Edited by admin on Fri Dec 15 21:31:57 UTC 2023
PRIMARY
EVMPD
SUB25476
Created by admin on Fri Dec 15 21:31:57 UTC 2023 , Edited by admin on Fri Dec 15 21:31:57 UTC 2023
PRIMARY
MERCK INDEX
m6202
Created by admin on Fri Dec 15 21:31:57 UTC 2023 , Edited by admin on Fri Dec 15 21:31:57 UTC 2023
PRIMARY Merck Index
Related Record Type Details
TARGET -> INHIBITOR
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY