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Details

Stereochemistry RACEMIC
Molecular Formula C16H20O4
Molecular Weight 276.3276
Optical Activity ( + / - )
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl marasmate, (±)-

SMILES

[H][C@]12CC(C)(C)C[C@@]1([H])[C@@]3(C[C@]3(C=O)C(C=O)=C2)C(=O)OC

InChI

InChIKey=WWEGKHYWESCXOK-VVBGDLBDSA-N
InChI=1S/C16H20O4/c1-14(2)5-10-4-11(7-17)15(9-18)8-16(15,12(10)6-14)13(19)20-3/h4,7,9-10,12H,5-6,8H2,1-3H3/t10-,12+,15-,16-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
Methyl marasmate, (±)-
Common Name English
(±)-Methyl marasmate
Common Name English
(±)-Marasmic acid methyl ester
Common Name English
rel-Methyl (1aR,1bR,4aR,6aS)-6,6a-diformyl-1b,2,3,4,4a,6a-hexahydro-3,3-dimethylcycloprop[e]indene-1a(1H)-carboxylate
Systematic Name English
Cycloprop[e]indene-1a(1H)-carboxylic acid, 6,6a-diformyl-1b,2,3,4,4a,6a-hexahydro-3,3-dimethyl-, methyl ester, (1aR,1bR,4aR,6aS)-rel-
Systematic Name English
Code System Code Type Description
FDA UNII
XNL8PU8JNA
Created by admin on Sat Dec 16 19:01:14 GMT 2023 , Edited by admin on Sat Dec 16 19:01:14 GMT 2023
PRIMARY
PUBCHEM
15625101
Created by admin on Sat Dec 16 19:01:14 GMT 2023 , Edited by admin on Sat Dec 16 19:01:14 GMT 2023
PRIMARY
CAS
75918-37-5
Created by admin on Sat Dec 16 19:01:14 GMT 2023 , Edited by admin on Sat Dec 16 19:01:14 GMT 2023
PRIMARY