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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H16O8
Molecular Weight 384.3362
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5,6-DIMETHOXYSTERIGMATOCYSTIN

SMILES

[H][C@]12OC=C[C@@]1([H])C3=C(O2)C=C(OC)C4=C3OC5=C(C4=O)C(O)=CC(OC)=C5OC

InChI

InChIKey=RSPJLZQIZABVSE-FFVOIRBGSA-N
InChI=1S/C20H16O8/c1-23-10-7-11-13(8-4-5-26-20(8)27-11)18-15(10)16(22)14-9(21)6-12(24-2)17(25-3)19(14)28-18/h4-8,20-21H,1-3H3/t8-,20+/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H16O8
Molecular Weight 384.3362
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:01:47 GMT 2023
Edited
by admin
on Sat Dec 16 11:01:47 GMT 2023
Record UNII
J0FSI1YC2L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5,6-DIMETHOXYSTERIGMATOCYSTIN
Common Name English
5,6-DIMETHOXYSTERIGMATOCYSTIN, 3A,12C-DIHYDRO-8-HYDROXY-6,10,11-TRIMETHOXY-, (3AR,12CS)-
Common Name English
7H-FURO(3',2':4,5)FURO(2,3-C)XANTHEN-7-ONE, 3A,12C-DIHYDRO-8-HYDROXY-6,10,11-TRIMETHOXY-, (3AR,12CS)-
Systematic Name English
7H-FURO(3',2':4,5)FURO(2,3-C)XANTHEN-7-ONE, 3A,12C-DIHYDRO-8-HYDROXY-6,10,11-TRIMETHOXY-, (3AR-CIS)-
Systematic Name English
Code System Code Type Description
CAS
65176-75-2
Created by admin on Sat Dec 16 11:01:47 GMT 2023 , Edited by admin on Sat Dec 16 11:01:47 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
FDA UNII
J0FSI1YC2L
Created by admin on Sat Dec 16 11:01:47 GMT 2023 , Edited by admin on Sat Dec 16 11:01:47 GMT 2023
PRIMARY
PUBCHEM
101683037
Created by admin on Sat Dec 16 11:01:47 GMT 2023 , Edited by admin on Sat Dec 16 11:01:47 GMT 2023
PRIMARY
EPA CompTox
DTXSID1020489
Created by admin on Sat Dec 16 11:01:47 GMT 2023 , Edited by admin on Sat Dec 16 11:01:47 GMT 2023
PRIMARY