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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H16O9
Molecular Weight 340.2821
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ESCULIN

SMILES

OC[C@H]1O[C@@H](OC2=C(O)C=C3OC(=O)C=CC3=C2)[C@H](O)[C@@H](O)[C@@H]1O

InChI

InChIKey=XHCADAYNFIFUHF-TVKJYDDYSA-N
InChI=1S/C15H16O9/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-3-6-1-2-11(18)22-8(6)4-7(9)17/h1-4,10,12-17,19-21H,5H2/t10-,12-,13+,14-,15-/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H16O9
Molecular Weight 340.2821
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:03:13 UTC 2023
Edited
by admin
on Fri Dec 15 15:03:13 UTC 2023
Record UNII
1Y1L18LQAF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ESCULIN
INCI   MI  
INCI  
Official Name English
POLYCHROME
Common Name English
ESCULINA
Common Name English
NSC-26665
Code English
AESCULINUM
HPUS  
Common Name English
ESCULIN [MI]
Common Name English
AESCULIN
Common Name English
ESCOSYL
Common Name English
6,7-DIHYDROXYCOUMARIN 6-GLUCOSIDE
Common Name English
Esculoside [WHO-DD]
Common Name English
ESCULIN [INCI]
Common Name English
ESCULOSIDE
JAN   WHO-DD  
Common Name English
ENALLACHROME
Common Name English
BICOLORIN
Common Name English
6-(.BETA.-D-GLUCOPYRANOSYLOXY)-7-HYDROXY-2H-1-BENZOPYRAN-2-ONE
Common Name English
AESCULINUM [HPUS]
Common Name English
ESCULOSIDE [JAN]
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
208-517-5
Created by admin on Fri Dec 15 15:03:13 UTC 2023 , Edited by admin on Fri Dec 15 15:03:13 UTC 2023
PRIMARY
RXCUI
1314351
Created by admin on Fri Dec 15 15:03:13 UTC 2023 , Edited by admin on Fri Dec 15 15:03:13 UTC 2023
PRIMARY RxNorm
NCI_THESAURUS
C83696
Created by admin on Fri Dec 15 15:03:13 UTC 2023 , Edited by admin on Fri Dec 15 15:03:13 UTC 2023
PRIMARY
CHEBI
4853
Created by admin on Fri Dec 15 15:03:13 UTC 2023 , Edited by admin on Fri Dec 15 15:03:13 UTC 2023
PRIMARY
SMS_ID
100000091250
Created by admin on Fri Dec 15 15:03:13 UTC 2023 , Edited by admin on Fri Dec 15 15:03:13 UTC 2023
PRIMARY
NCI_THESAURUS
C45678
Created by admin on Fri Dec 15 15:03:13 UTC 2023 , Edited by admin on Fri Dec 15 15:03:13 UTC 2023
CONCEPT Industrial Aid
PUBCHEM
5281417
Created by admin on Fri Dec 15 15:03:13 UTC 2023 , Edited by admin on Fri Dec 15 15:03:13 UTC 2023
PRIMARY
WIKIPEDIA
AESCULIN
Created by admin on Fri Dec 15 15:03:13 UTC 2023 , Edited by admin on Fri Dec 15 15:03:13 UTC 2023
PRIMARY
EPA CompTox
DTXSID7045318
Created by admin on Fri Dec 15 15:03:13 UTC 2023 , Edited by admin on Fri Dec 15 15:03:13 UTC 2023
PRIMARY
NSC
26665
Created by admin on Fri Dec 15 15:03:13 UTC 2023 , Edited by admin on Fri Dec 15 15:03:13 UTC 2023
PRIMARY
EVMPD
SUB26025
Created by admin on Fri Dec 15 15:03:13 UTC 2023 , Edited by admin on Fri Dec 15 15:03:13 UTC 2023
PRIMARY
CAS
531-75-9
Created by admin on Fri Dec 15 15:03:13 UTC 2023 , Edited by admin on Fri Dec 15 15:03:13 UTC 2023
PRIMARY
MESH
D004929
Created by admin on Fri Dec 15 15:03:13 UTC 2023 , Edited by admin on Fri Dec 15 15:03:13 UTC 2023
PRIMARY
DRUG BANK
DB13155
Created by admin on Fri Dec 15 15:03:13 UTC 2023 , Edited by admin on Fri Dec 15 15:03:13 UTC 2023
PRIMARY
DAILYMED
1Y1L18LQAF
Created by admin on Fri Dec 15 15:03:13 UTC 2023 , Edited by admin on Fri Dec 15 15:03:13 UTC 2023
PRIMARY
MERCK INDEX
m5023
Created by admin on Fri Dec 15 15:03:13 UTC 2023 , Edited by admin on Fri Dec 15 15:03:13 UTC 2023
PRIMARY Merck Index
FDA UNII
1Y1L18LQAF
Created by admin on Fri Dec 15 15:03:13 UTC 2023 , Edited by admin on Fri Dec 15 15:03:13 UTC 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
PARENT -> CONSTITUENT ALWAYS PRESENT
SOLVATE->ANHYDROUS
PARENT -> CONSTITUENT ALWAYS PRESENT
SALT/SOLVATE -> PARENT
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ACTIVE MOIETY