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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H26O6
Molecular Weight 386.4382
Optical Activity UNSPECIFIED
Additional Stereochemistry Yes
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0
Stereo Comments AXIAL, R

SHOW SMILES / InChI
Structure of GOMISIN M2, (+)-

SMILES

COC1=C(OC)C(OC)=C2C(C[C@H](C)[C@H](C)CC3=CC4=C(OCO4)C(O)=C23)=C1

InChI

InChIKey=PDDXWOMYBJCSQB-NEPJUHHUSA-N
InChI=1S/C22H26O6/c1-11-6-13-9-16-20(28-10-27-16)19(23)17(13)18-14(7-12(11)2)8-15(24-3)21(25-4)22(18)26-5/h8-9,11-12,23H,6-7,10H2,1-5H3/t11-,12+/m1/s1

HIDE SMILES / InChI

Molecular Formula C22H26O6
Molecular Weight 386.4382
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 11:10:51 GMT 2023
Edited
by admin
on Sat Dec 16 11:10:51 GMT 2023
Record UNII
1A09299J9W
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GOMISIN M2, (+)-
Common Name English
GOMISIN M2
Common Name English
BENZO(3,4)CYCLOOCTA(1,2-F)(1,3)BENZODIOXOL-13-OL, 5,6,7,8-TETRAHYDRO-1,2,3-TRIMETHOXY-6,7-DIMETHYL-, (6S,7R,13AR)-
Systematic Name English
(+)-GOMISIN M2
Common Name English
Code System Code Type Description
CAS
82425-45-4
Created by admin on Sat Dec 16 11:10:51 GMT 2023 , Edited by admin on Sat Dec 16 11:10:51 GMT 2023
PRIMARY
PUBCHEM
14992068
Created by admin on Sat Dec 16 11:10:51 GMT 2023 , Edited by admin on Sat Dec 16 11:10:51 GMT 2023
PRIMARY
EPA CompTox
DTXSID101318538
Created by admin on Sat Dec 16 11:10:51 GMT 2023 , Edited by admin on Sat Dec 16 11:10:51 GMT 2023
PRIMARY
FDA UNII
1A09299J9W
Created by admin on Sat Dec 16 11:10:51 GMT 2023 , Edited by admin on Sat Dec 16 11:10:51 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT