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Details

Stereochemistry RACEMIC
Molecular Formula C5H10O10P2
Molecular Weight 292.0744
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BUTEDRONIC ACID

SMILES

OC(=O)CC(C(P(O)(O)=O)P(O)(O)=O)C(O)=O

InChI

InChIKey=LDTZSTJLVYBEKB-UHFFFAOYSA-N
InChI=1S/C5H10O10P2/c6-3(7)1-2(4(8)9)5(16(10,11)12)17(13,14)15/h2,5H,1H2,(H,6,7)(H,8,9)(H2,10,11,12)(H2,13,14,15)

HIDE SMILES / InChI

Molecular Formula C5H10O10P2
Molecular Weight 292.0744
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 16:53:45 UTC 2023
Edited
by admin
on Sat Dec 16 16:53:45 UTC 2023
Record UNII
26PB1U68YF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BUTEDRONIC ACID
INN   MI  
INN  
Official Name English
BUTEDRONIC ACID, (±)-
Common Name English
(DIPHOSPHONOMETHYL)SUCCINIC ACID
Systematic Name English
BUTEDRONIC ACID [MI]
Common Name English
3,3-diphosphono-1,2-propanedicarbonic acid [WHO-DD]
Common Name English
2-(DIPHOSPHONOMETHYL)SUCCINIC ACID
Systematic Name English
butedronic acid [INN]
Common Name English
(±)-BUTEDRONIC ACID
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C67439
Created by admin on Sat Dec 16 16:53:46 UTC 2023 , Edited by admin on Sat Dec 16 16:53:46 UTC 2023
NCI_THESAURUS C443
Created by admin on Sat Dec 16 16:53:46 UTC 2023 , Edited by admin on Sat Dec 16 16:53:46 UTC 2023
Code System Code Type Description
CAS
51395-42-7
Created by admin on Sat Dec 16 16:53:46 UTC 2023 , Edited by admin on Sat Dec 16 16:53:46 UTC 2023
PRIMARY
NCI_THESAURUS
C72092
Created by admin on Sat Dec 16 16:53:46 UTC 2023 , Edited by admin on Sat Dec 16 16:53:46 UTC 2023
PRIMARY
EVMPD
SUB129128
Created by admin on Sat Dec 16 16:53:46 UTC 2023 , Edited by admin on Sat Dec 16 16:53:46 UTC 2023
PRIMARY
EPA CompTox
DTXSID30866196
Created by admin on Sat Dec 16 16:53:46 UTC 2023 , Edited by admin on Sat Dec 16 16:53:46 UTC 2023
PRIMARY
SMS_ID
100000088625
Created by admin on Sat Dec 16 16:53:46 UTC 2023 , Edited by admin on Sat Dec 16 16:53:46 UTC 2023
PRIMARY
INN
6239
Created by admin on Sat Dec 16 16:53:46 UTC 2023 , Edited by admin on Sat Dec 16 16:53:46 UTC 2023
PRIMARY
PUBCHEM
189891
Created by admin on Sat Dec 16 16:53:46 UTC 2023 , Edited by admin on Sat Dec 16 16:53:46 UTC 2023
PRIMARY
MERCK INDEX
m2790
Created by admin on Sat Dec 16 16:53:46 UTC 2023 , Edited by admin on Sat Dec 16 16:53:46 UTC 2023
PRIMARY Merck Index
DRUG CENTRAL
3052
Created by admin on Sat Dec 16 16:53:46 UTC 2023 , Edited by admin on Sat Dec 16 16:53:46 UTC 2023
PRIMARY
EVMPD
SUB12682MIG
Created by admin on Sat Dec 16 16:53:46 UTC 2023 , Edited by admin on Sat Dec 16 16:53:46 UTC 2023
PRIMARY
FDA UNII
26PB1U68YF
Created by admin on Sat Dec 16 16:53:46 UTC 2023 , Edited by admin on Sat Dec 16 16:53:46 UTC 2023
PRIMARY
ChEMBL
CHEMBL2106599
Created by admin on Sat Dec 16 16:53:46 UTC 2023 , Edited by admin on Sat Dec 16 16:53:46 UTC 2023
PRIMARY
EVMPD
SUB06011MIG
Created by admin on Sat Dec 16 16:53:46 UTC 2023 , Edited by admin on Sat Dec 16 16:53:46 UTC 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
SALT/SOLVATE -> PARENT
SOLVATE->ANHYDROUS
ENANTIOMER -> RACEMATE
Related Record Type Details
ACTIVE MOIETY