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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H20O4
Molecular Weight 264.3169
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HELIESPIRONE A

SMILES

CC1=CC(=O)[C@]2(CC1=O)O[C@@H](C[C@@H]2C=C)C(C)(C)O

InChI

InChIKey=MATQAMIEUDKYBO-VZJVUDMVSA-N
InChI=1S/C15H20O4/c1-5-10-7-13(14(3,4)18)19-15(10)8-11(16)9(2)6-12(15)17/h5-6,10,13,18H,1,7-8H2,2-4H3/t10-,13-,15+/m0/s1

HIDE SMILES / InChI

Molecular Formula C15H20O4
Molecular Weight 264.3169
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 16:32:20 UTC 2023
Edited
by admin
on Sat Dec 16 16:32:20 UTC 2023
Record UNII
4VJ9NG6F0F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HELIESPIRONE A
Common Name English
(-)-HELIESPIRONE A
Common Name English
1-EPI-HELIESPIRONE C
Common Name English
1-OXASPIRO(4.5)DEC-7-ENE-6,9-DIONE, 4-ETHENYL-2-(1-HYDROXY-1-METHYLETHYL)-8-METHYL-, (2S,4R,5R)-
Systematic Name English
(2S,4R,5R)-4-ETHENYL-2-(1-HYDROXY-1-METHYLETHYL)-8-METHYL-1-OXASPIRO(4.5)DEC-7-ENE-6,9-DIONE
Systematic Name English
HELIESPIRONE A [MI]
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID601119757
Created by admin on Sat Dec 16 16:32:20 UTC 2023 , Edited by admin on Sat Dec 16 16:32:20 UTC 2023
PRIMARY
MERCK INDEX
m11868
Created by admin on Sat Dec 16 16:32:20 UTC 2023 , Edited by admin on Sat Dec 16 16:32:20 UTC 2023
PRIMARY
PUBCHEM
71484130
Created by admin on Sat Dec 16 16:32:20 UTC 2023 , Edited by admin on Sat Dec 16 16:32:20 UTC 2023
PRIMARY
CAS
202533-71-9
Created by admin on Sat Dec 16 16:32:20 UTC 2023 , Edited by admin on Sat Dec 16 16:32:20 UTC 2023
PRIMARY
FDA UNII
4VJ9NG6F0F
Created by admin on Sat Dec 16 16:32:20 UTC 2023 , Edited by admin on Sat Dec 16 16:32:20 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT