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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H30O7
Molecular Weight 430.4908
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ATHAMANTIN

SMILES

CC(C)CC(=O)O[C@H]1[C@H](OC2=CC=C3C=CC(=O)OC3=C12)C(C)(C)OC(=O)CC(C)C

InChI

InChIKey=KPLBOWKEQXYXSD-PKTZIBPZSA-N
InChI=1S/C24H30O7/c1-13(2)11-18(26)30-22-20-16(9-7-15-8-10-17(25)29-21(15)20)28-23(22)24(5,6)31-19(27)12-14(3)4/h7-10,13-14,22-23H,11-12H2,1-6H3/t22-,23+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
ATHAMANTIN
MI  
Common Name English
(8S-CIS)-3-METHYLBUTANOIC ACID 8,9-DIHYDRO-8-(1-METHYL-1-(3-METHYL-1-OXOBUTOXY)ETHYL)-2-OXO-2H-FURO(2,3-H)-1-BENZOPYRAN-9-YL ESTER
Preferred Name English
ATHAMANTIN [MI]
Common Name English
Code System Code Type Description
PUBCHEM
442051
Created by admin on Mon Mar 31 19:16:11 GMT 2025 , Edited by admin on Mon Mar 31 19:16:11 GMT 2025
PRIMARY
FDA UNII
N64VN7M7WB
Created by admin on Mon Mar 31 19:16:11 GMT 2025 , Edited by admin on Mon Mar 31 19:16:11 GMT 2025
PRIMARY
MERCK INDEX
m2121
Created by admin on Mon Mar 31 19:16:11 GMT 2025 , Edited by admin on Mon Mar 31 19:16:11 GMT 2025
PRIMARY Merck Index
EPA CompTox
DTXSID30172320
Created by admin on Mon Mar 31 19:16:11 GMT 2025 , Edited by admin on Mon Mar 31 19:16:11 GMT 2025
PRIMARY
CAS
1892-56-4
Created by admin on Mon Mar 31 19:16:11 GMT 2025 , Edited by admin on Mon Mar 31 19:16:11 GMT 2025
PRIMARY