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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H28O6
Molecular Weight 388.4541
Optical Activity UNSPECIFIED
Additional Stereochemistry Yes
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0
Stereo Comments AXIAL, S

SHOW SMILES / InChI
Structure of GOMISIN J

SMILES

COC1=C(O)C=C2C[C@H](C)[C@H](C)CC3=CC(O)=C(OC)C(OC)=C3C2=C1OC

InChI

InChIKey=PICOUNAPKDEPCA-TXEJJXNPSA-N
InChI=1S/C22H28O6/c1-11-7-13-9-15(23)19(25-3)21(27-5)17(13)18-14(8-12(11)2)10-16(24)20(26-4)22(18)28-6/h9-12,23-24H,7-8H2,1-6H3/t11-,12+

HIDE SMILES / InChI

Molecular Formula C22H28O6
Molecular Weight 388.4541
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 11:16:29 UTC 2023
Edited
by admin
on Sat Dec 16 11:16:29 UTC 2023
Record UNII
X13A57600T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GOMISIN J
Common Name English
(-)-GOMISIN J
Common Name English
DIBENZO(A,C)CYCLOOCTENE-3,10-DIOL, 5,6,7,8-TETRAHYDRO-1,2,11,12-TETRAMETHOXY-6,7-DIMETHYL-, (6R,7S,12AS)-
Systematic Name English
Code System Code Type Description
FDA UNII
X13A57600T
Created by admin on Sat Dec 16 11:16:29 UTC 2023 , Edited by admin on Sat Dec 16 11:16:29 UTC 2023
PRIMARY
CAS
66280-25-9
Created by admin on Sat Dec 16 11:16:29 UTC 2023 , Edited by admin on Sat Dec 16 11:16:29 UTC 2023
PRIMARY
EPA CompTox
DTXSID30216490
Created by admin on Sat Dec 16 11:16:29 UTC 2023 , Edited by admin on Sat Dec 16 11:16:29 UTC 2023
PRIMARY
PUBCHEM
3001686
Created by admin on Sat Dec 16 11:16:29 UTC 2023 , Edited by admin on Sat Dec 16 11:16:29 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT