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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H28O13
Molecular Weight 476.4285
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PRIMULAVERIN

SMILES

COC(=O)C1=C(O[C@@H]2O[C@H](CO[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)C=CC(OC)=C1

InChI

InChIKey=CDWVFJJMYKSVHM-HSMQXHTESA-N
InChI=1S/C20H28O13/c1-28-8-3-4-11(9(5-8)18(27)29-2)32-20-17(26)15(24)14(23)12(33-20)7-31-19-16(25)13(22)10(21)6-30-19/h3-5,10,12-17,19-26H,6-7H2,1-2H3/t10-,12-,13+,14-,15+,16-,17-,19+,20-/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H28O13
Molecular Weight 476.4285
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:05:11 GMT 2023
Edited
by admin
on Sat Dec 16 08:05:11 GMT 2023
Record UNII
0B99IC5K2E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PRIMULAVERIN
MI  
Common Name English
PRIMULAVERIN [MI]
Common Name English
PRIMULAVEROSIDE
Common Name English
BENZOIC ACID, 5-METHOXY-2-((6-O-.BETA.-D-XYLOPYRANOSYL-.BETA.-D-GLUCOPYRANOSYL)OXY)-, METHYL ESTER
Systematic Name English
2-HYDROXY-5-METHOXY-METHYL BENZOATE-2-PRIMEVEROSIDE
Common Name English
Code System Code Type Description
MERCK INDEX
m9137
Created by admin on Sat Dec 16 08:05:11 GMT 2023 , Edited by admin on Sat Dec 16 08:05:11 GMT 2023
PRIMARY Merck Index
PUBCHEM
3083558
Created by admin on Sat Dec 16 08:05:11 GMT 2023 , Edited by admin on Sat Dec 16 08:05:11 GMT 2023
PRIMARY
CAS
154-61-0
Created by admin on Sat Dec 16 08:05:11 GMT 2023 , Edited by admin on Sat Dec 16 08:05:11 GMT 2023
PRIMARY
EPA CompTox
DTXSID00934891
Created by admin on Sat Dec 16 08:05:11 GMT 2023 , Edited by admin on Sat Dec 16 08:05:11 GMT 2023
PRIMARY
FDA UNII
0B99IC5K2E
Created by admin on Sat Dec 16 08:05:11 GMT 2023 , Edited by admin on Sat Dec 16 08:05:11 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT
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