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Details

Stereochemistry RACEMIC
Molecular Formula C18H23NO4
Molecular Weight 317.3795
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Pandamarilactonine B

SMILES

CC1=C[C@@H](OC1=O)[C@@H]2CCCN2CCC\C=C3/OC(=O)C(C)=C3

InChI

InChIKey=HSICZNIIIPFAAO-VFPQPWSNSA-N
InChI=1S/C18H23NO4/c1-12-10-14(22-17(12)20)6-3-4-8-19-9-5-7-15(19)16-11-13(2)18(21)23-16/h6,10-11,15-16H,3-5,7-9H2,1-2H3/b14-6-/t15-,16+/m0/s1

HIDE SMILES / InChI

Molecular Formula C18H23NO4
Molecular Weight 317.3795
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 05:42:31 GMT 2025
Edited
by admin
on Wed Apr 02 05:42:31 GMT 2025
Record UNII
2XPR8MF7VQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2(5H)-Furanone, 5-[4-[(2R)-2-[(2S)-2,5-dihydro-4-methyl-5-oxo-2-furanyl]-1-pyrrolidinyl]butylidene]-3-methyl-, (5Z)-rel-
Preferred Name English
Pandamarilactonine B
Common Name English
3-METHYL-5-(4-((2R)-2-((2R)-4-METHYL-5-OXIDANYLIDENE-2H-FURAN-2-YL)PYRROLIDIN-1-YL)BUTYLIDENE)FURAN-2-ONE
Systematic Name English
rel-(5Z)-5-[4-[(2R)-2-[(2S)-2,5-Dihydro-4-methyl-5-oxo-2-furanyl]-1-pyrrolidinyl]butylidene]-3-methyl-2(5H)-furanone
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID801106358
Created by admin on Wed Apr 02 05:42:31 GMT 2025 , Edited by admin on Wed Apr 02 05:42:31 GMT 2025
PRIMARY
CAS
303008-81-3
Created by admin on Wed Apr 02 05:42:31 GMT 2025 , Edited by admin on Wed Apr 02 05:42:31 GMT 2025
PRIMARY
FDA UNII
2XPR8MF7VQ
Created by admin on Wed Apr 02 05:42:31 GMT 2025 , Edited by admin on Wed Apr 02 05:42:31 GMT 2025
PRIMARY
PUBCHEM
91885041
Created by admin on Wed Apr 02 05:42:31 GMT 2025 , Edited by admin on Wed Apr 02 05:42:31 GMT 2025
PRIMARY