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Details

Stereochemistry ABSOLUTE
Molecular Formula C31H42O18
Molecular Weight 702.6544
Optical Activity UNSPECIFIED
Defined Stereocenters 12 / 12
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of OLEUROPEINYL MONOGLUCOSIDE

SMILES

COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)\C(=C\C)[C@@H]1CC(=O)OCCC3=CC(O)=C(O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)C=C3

InChI

InChIKey=TZKSBCFVWWWMJO-GVJOCCLKSA-N
InChI=1S/C31H42O18/c1-3-14-15(16(28(42)43-2)12-45-29(14)49-31-27(41)25(39)23(37)20(11-33)48-31)9-21(35)44-7-6-13-4-5-18(17(34)8-13)46-30-26(40)24(38)22(36)19(10-32)47-30/h3-5,8,12,15,19-20,22-27,29-34,36-41H,6-7,9-11H2,1-2H3/b14-3+/t15-,19+,20+,22+,23+,24-,25-,26+,27+,29-,30-,31-/m0/s1

HIDE SMILES / InChI

Molecular Formula C31H42O18
Molecular Weight 702.6544
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 12 / 12
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 21:02:34 GMT 2025
Edited
by admin
on Mon Mar 31 21:02:34 GMT 2025
Record UNII
ZV196Z05LZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2H-PYRAN-4-ACETIC ACID, 3-ETHYLIDENE-2-(.BETA.-D-GLUCOPYRANOSYLOXY)-3,4-DIHYDRO-5-(METHOXYCARBONYL)-, 2-(4-(.ALPHA.-D-GLUCOPYRANOSYLOXY)-3-HYDROXYPHENYL)ETHYL ESTER, (2S,3E,4S)-
Preferred Name English
OLEUROPEINYL MONOGLUCOSIDE
Common Name English
INOVEOL OLEU (MONO GLU)
Common Name English
Code System Code Type Description
FDA UNII
ZV196Z05LZ
Created by admin on Mon Mar 31 21:02:34 GMT 2025 , Edited by admin on Mon Mar 31 21:02:34 GMT 2025
PRIMARY
PUBCHEM
71587954
Created by admin on Mon Mar 31 21:02:34 GMT 2025 , Edited by admin on Mon Mar 31 21:02:34 GMT 2025
PRIMARY
CAS
1235443-54-5
Created by admin on Mon Mar 31 21:02:34 GMT 2025 , Edited by admin on Mon Mar 31 21:02:34 GMT 2025
PRIMARY
EPA CompTox
DTXSID00154037
Created by admin on Mon Mar 31 21:02:34 GMT 2025 , Edited by admin on Mon Mar 31 21:02:34 GMT 2025
PRIMARY