Products 1381875-14-4

CAS 1381875-14-4 is the registry number for Acropyrone. Offered by: GLPBio, MedChemExpress. Available pack sizes: 5mg, Get quote.

Acropyrone
GLPBio, MedChemExpress
  • size: 5mg, Get quote
  • Variants: 2
from 4360.16
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Structural formula: {0} (CAS {1})

1-[6-[1-[3-acetyl-2,6-dihydroxy-4-methoxy-5-(3-methylbut-2-enyl)phenyl]-3-methylbutyl]-5,7-dihydroxy-2,2-dimethylchromen-8-yl]ethanone (CAS 1381875-14-4) is a chemical compound with the molecular formula C32H40O8 and a molecular weight of 552.7 g/mol. IUPAC name: 1-[6-[1-[3-acetyl-2,6-dihydroxy-4-methoxy-5-(3-methylbut-2-enyl)phenyl]-3-methylbutyl]-5,7-dihydroxy-2,2-dimethylchromen-8-yl]ethanone. InChIKey: FABHBJUSRZUNRG-UHFFFAOYSA-N.

Identity
Molecular formulaC32H40O8
Molecular weight552.7 g/mol
IUPAC name1-[6-[1-[3-acetyl-2,6-dihydroxy-4-methoxy-5-(3-methylbut-2-enyl)phenyl]-3-methylbutyl]-5,7-dihydroxy-2,2-dimethylchromen-8-yl]ethanone
InChIKeyFABHBJUSRZUNRG-UHFFFAOYSA-N
SMILESCC(C)CC(C1=C(C(=C2C(=C1O)C=CC(O2)(C)C)C(=O)C)O)C3=C(C(=C(C(=C3O)CC=C(C)C)OC)C(=O)C)O

Computed by PubChem (NCBI)

Isomers (same molecular formula)
[(1'R,2R,3'E,5'R,7'S,11'S,12'R,13'S,14'S)-1',11'-diacetyloxy-3',6',6',14'-tetramethyl-2'-oxospiro[oxirane-2,10'-tricyclo[10.3.0.05,7]pentadec-3-ene]-13'-yl] 2-phenylacetate C32H40O8
[(1'R,2R,3'Z,5'R,7'S,11'S,12'R,13'S,14'S)-1',11'-diacetyloxy-3',6',6',14'-tetramethyl-2'-oxospiro[oxirane-2,10'-tricyclo[10.3.0.05,7]pentadec-3-ene]-13'-yl] 2-phenylacetate C32H40O8
[(2'R,5R,6S,9'S,9bS)-2',6-dihydroxy-2',6,9,11'-tetramethyl-6'-methylidene-2,7'-dioxospiro[4,5,6a,7,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-3,15'-8-oxatetracyclo[9.2.2.01,10.05,9]pentadec-12-ene]-5-yl] acetate C32H40O8