U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C42H30N6O12
Molecular Weight 810.7206
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of INOSITOL NIACINATE

SMILES

O=C(O[C@@H]1[C@H](OC(=O)C2=CN=CC=C2)[C@H](OC(=O)C3=CN=CC=C3)[C@@H](OC(=O)C4=CN=CC=C4)[C@H](OC(=O)C5=CN=CC=C5)[C@H]1OC(=O)C6=CN=CC=C6)C7=CN=CC=C7

InChI

InChIKey=MFZCIDXOLLEMOO-GYSGTQPESA-N
InChI=1S/C42H30N6O12/c49-37(25-7-1-13-43-19-25)55-31-32(56-38(50)26-8-2-14-44-20-26)34(58-40(52)28-10-4-16-46-22-28)36(60-42(54)30-12-6-18-48-24-30)35(59-41(53)29-11-5-17-47-23-29)33(31)57-39(51)27-9-3-15-45-21-27/h1-24,31-36H/t31-,32-,33-,34+,35-,36-

HIDE SMILES / InChI

Molecular Formula C42H30N6O12
Molecular Weight 810.7206
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:01:35 UTC 2023
Edited
by admin
on Fri Dec 15 15:01:35 UTC 2023
Record UNII
A99MK953KZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
INOSITOL NIACINATE
MI   USAN  
USAN  
Official Name English
DILCIT
Brand Name English
Inositol nicotinate [WHO-DD]
Common Name English
inositol nicotinate [INN]
Common Name English
INOSITOL HEXANICOTINATE [JAN]
Common Name English
MESONEX
Brand Name English
WIN-9154
Code English
WIN 9154
Code English
HEXOPAL
Brand Name English
NSC-49506
Code English
INOSITOL NIACINATE [USAN]
Common Name English
HAMOVANNID
Brand Name English
1,2,3,5/4,6 CYCLOHEXANEHEXOL HEXANICOTINATE
Common Name English
LINODIL
Brand Name English
PALOHEX
Brand Name English
ESANTENE
Brand Name English
myo-Inositol hexanicotinate
Common Name English
HEXANICIT
Brand Name English
MESOTAL
Brand Name English
INOSITOL NICOTINATE
INN   MART.   WHO-DD  
INN  
Official Name English
INOSITOL NIACINATE [MI]
Common Name English
HEXANICOTOL
Brand Name English
INOSITOL HEXANICOTINATE
JAN  
Common Name English
INOSITOL NICOTINATE [MART.]
Common Name English
DILEXPAL
Brand Name English
Classification Tree Code System Code
WHO-VATC QC04AC03
Created by admin on Fri Dec 15 15:01:35 UTC 2023 , Edited by admin on Fri Dec 15 15:01:35 UTC 2023
DSLD 1075 (Number of products:51)
Created by admin on Fri Dec 15 15:01:35 UTC 2023 , Edited by admin on Fri Dec 15 15:01:35 UTC 2023
NCI_THESAURUS C98151
Created by admin on Fri Dec 15 15:01:35 UTC 2023 , Edited by admin on Fri Dec 15 15:01:35 UTC 2023
WHO-ATC C04AC03
Created by admin on Fri Dec 15 15:01:35 UTC 2023 , Edited by admin on Fri Dec 15 15:01:35 UTC 2023
Code System Code Type Description
EVMPD
SUB08192MIG
Created by admin on Fri Dec 15 15:01:35 UTC 2023 , Edited by admin on Fri Dec 15 15:01:35 UTC 2023
PRIMARY
NSC
49506
Created by admin on Fri Dec 15 15:01:35 UTC 2023 , Edited by admin on Fri Dec 15 15:01:35 UTC 2023
PRIMARY
EPA CompTox
DTXSID2023147
Created by admin on Fri Dec 15 15:01:35 UTC 2023 , Edited by admin on Fri Dec 15 15:01:35 UTC 2023
PRIMARY
CHEBI
33064
Created by admin on Fri Dec 15 15:01:35 UTC 2023 , Edited by admin on Fri Dec 15 15:01:35 UTC 2023
PRIMARY
CHEBI
31699
Created by admin on Fri Dec 15 15:01:35 UTC 2023 , Edited by admin on Fri Dec 15 15:01:35 UTC 2023
PRIMARY
DRUG BANK
DB08949
Created by admin on Fri Dec 15 15:01:35 UTC 2023 , Edited by admin on Fri Dec 15 15:01:35 UTC 2023
PRIMARY
DRUG CENTRAL
1445
Created by admin on Fri Dec 15 15:01:35 UTC 2023 , Edited by admin on Fri Dec 15 15:01:35 UTC 2023
PRIMARY
CAS
6556-11-2
Created by admin on Fri Dec 15 15:01:35 UTC 2023 , Edited by admin on Fri Dec 15 15:01:35 UTC 2023
PRIMARY
ECHA (EC/EINECS)
229-485-9
Created by admin on Fri Dec 15 15:01:35 UTC 2023 , Edited by admin on Fri Dec 15 15:01:35 UTC 2023
PRIMARY
SMS_ID
100000088899
Created by admin on Fri Dec 15 15:01:35 UTC 2023 , Edited by admin on Fri Dec 15 15:01:35 UTC 2023
PRIMARY
FDA UNII
A99MK953KZ
Created by admin on Fri Dec 15 15:01:35 UTC 2023 , Edited by admin on Fri Dec 15 15:01:35 UTC 2023
PRIMARY
DAILYMED
A99MK953KZ
Created by admin on Fri Dec 15 15:01:35 UTC 2023 , Edited by admin on Fri Dec 15 15:01:35 UTC 2023
PRIMARY
MERCK INDEX
m6292
Created by admin on Fri Dec 15 15:01:35 UTC 2023 , Edited by admin on Fri Dec 15 15:01:35 UTC 2023
PRIMARY Merck Index
INN
1160
Created by admin on Fri Dec 15 15:01:35 UTC 2023 , Edited by admin on Fri Dec 15 15:01:35 UTC 2023
PRIMARY
ChEMBL
CHEMBL1094982
Created by admin on Fri Dec 15 15:01:35 UTC 2023 , Edited by admin on Fri Dec 15 15:01:35 UTC 2023
PRIMARY
CHEBI
50134
Created by admin on Fri Dec 15 15:01:35 UTC 2023 , Edited by admin on Fri Dec 15 15:01:35 UTC 2023
PRIMARY
RXCUI
27604
Created by admin on Fri Dec 15 15:01:35 UTC 2023 , Edited by admin on Fri Dec 15 15:01:35 UTC 2023
PRIMARY RxNorm
WIKIPEDIA
Inositol nicotinate
Created by admin on Fri Dec 15 15:01:35 UTC 2023 , Edited by admin on Fri Dec 15 15:01:35 UTC 2023
PRIMARY
NCI_THESAURUS
C75996
Created by admin on Fri Dec 15 15:01:35 UTC 2023 , Edited by admin on Fri Dec 15 15:01:35 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY
ACTIVE MOIETY