MERRILACTONE A

Details

Stereochemistry	EPIMERIC
Molecular Formula	C15H18O6
Molecular Weight	294.2998
Optical Activity	( + )
Defined Stereocenters	6 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC12O[C@@H]3[C@]14CC(=O)O[C@@]4(C[C@@H]2O)[C@]5(C)COC(=O)[C@]35C

InChI

InChIKey=RJVZPYYKUUJWSI-OTRJQXFMSA-N

InChI=1S/C15H18O6/c1-11-6-19-10(18)12(11,2)9-14-5-8(17)20-15(11,14)4-7(16)13(14,3)21-9/h7,9,16H,4-6H2,1-3H3/t7-,9-,11+,12-,13?,14+,15-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C15H18O6
Molecular Weight	294.2998
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	6 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 09:59:08 GMT 2025` Edited by `admin` on `Wed Apr 02 09:59:08 GMT 2025`
Record UNII	DZS2XP3QH2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MERRILACTONE A

Common Name

English

(+)-Merrilactone A

Preferred Name

English

(2S,2AS,5AS,5BS,8AS,8BR,10S)-TETRAHYDRO-10-HYDROXY-2,5B,8A-TRIMETHYL-2,5A-ETHANO-2H,5AH,8H-FURO(3',4':4,5)OXETO(3',2':2,3)CYCLOPENTA(1,2-B)FURAN-4,8(3H)-DIONE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID101028870