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Details

Stereochemistry ACHIRAL
Molecular Formula C28H36O8
Molecular Weight 500.5806
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ULIGINOSIN A

SMILES

CC(C)C(=O)C1=C(O)C(CC=C(C)C)=C(O)C(CC2=C(O)C(C)(C)C(O)=C(C(=O)C(C)C)C2=O)=C1O

InChI

InChIKey=SBVAYWWFCDLDFH-UHFFFAOYSA-N
InChI=1S/C28H36O8/c1-12(2)9-10-15-22(31)16(24(33)18(23(15)32)20(29)13(3)4)11-17-25(34)19(21(30)14(5)6)27(36)28(7,8)26(17)35/h9,13-14,31-33,35-36H,10-11H2,1-8H3

HIDE SMILES / InChI

Molecular Formula C28H36O8
Molecular Weight 500.5806
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:29:29 GMT 2023
Edited
by admin
on Sat Dec 16 08:29:29 GMT 2023
Record UNII
WPY2P733PC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ULIGINOSIN A
MI  
Common Name English
3,5-DIHYDROXY-4,4-DIMETHYL-2-(2-METHYL-1-OXOPROPYL)-6-((2,4,6-TRIHYDROXY-3-(3-METHYL-2-BUTENYL)-5-(2-METHYL-1-OXOPROPYL)PHENYL)METHYL)-2,5-CYCLOHEXADIEN-1-ONE
Systematic Name English
ULIGINOSIN A [MI]
Common Name English
2,5-CYCLOHEXADIEN-1-ONE, 3,5-DIHYDROXY-4,4-DIMETHYL-2-(2-METHYL-1-OXOPROPYL)-6-((2,4,6-TRIHYDROXY-3-(3-METHYL-2-BUTEN-1-YL)-5-(2-METHYL-1-OXOPROPYL)PHENYL)METHYL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
5315117
Created by admin on Sat Dec 16 08:29:29 GMT 2023 , Edited by admin on Sat Dec 16 08:29:29 GMT 2023
PRIMARY
MERCK INDEX
m11298
Created by admin on Sat Dec 16 08:29:29 GMT 2023 , Edited by admin on Sat Dec 16 08:29:29 GMT 2023
PRIMARY Merck Index
CAS
19809-78-0
Created by admin on Sat Dec 16 08:29:29 GMT 2023 , Edited by admin on Sat Dec 16 08:29:29 GMT 2023
PRIMARY
FDA UNII
WPY2P733PC
Created by admin on Sat Dec 16 08:29:29 GMT 2023 , Edited by admin on Sat Dec 16 08:29:29 GMT 2023
PRIMARY