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2H,6H-Benzo[1,2-b:5,4-b']dipyran-2-one, 7,8-dihydro-5,7-dihydroxy-8,8-dimethyl-10-(3-methyl-1-oxobutyl)-4-propyl-, (.+-.)-
SpectraBase Compound ID ILXpns9f4az
InChI InChI=1S/C22H28O6/c1-6-7-12-9-16(25)27-21-17(12)19(26)13-10-15(24)22(4,5)28-20(13)18(21)14(23)8-11(2)3/h9,11,15,24,26H,6-8,10H2,1-5H3
InChIKey IWXVZIMHJKPWIP-UHFFFAOYSA-N
Mol Weight 388.46 g/mol
Molecular Formula C22H28O6
Exact Mass 388.188589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 845ufRr8mOF
Name 2H,6H-Benzo[1,2-b:5,4-b']dipyran-2-one, 7,8-dihydro-5,7-dihydroxy-8,8-dimethyl-10-(3-methyl-1-oxobutyl)-4-propyl-, (.+-.)-
CAS Registry Number 111761-46-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28O6
InChI InChI=1S/C22H28O6/c1-6-7-12-9-16(25)27-21-17(12)19(26)13-10-15(24)22(4,5)28-20(13)18(21)14(23)8-11(2)3/h9,11,15,24,26H,6-8,10H2,1-5H3
InChIKey IWXVZIMHJKPWIP-UHFFFAOYSA-N
Molecular Weight 388.460 g/mol
SMILES OC1Cc2c(c(c3c(c2O)C(=CC(O3)=O)CCC)C(CC(C)C)=O)OC1(C)C
SPLASH splash10-001i-0029000000-77ea4b917056b0b90d7c
Source of Spectrum KC-1987-329-4
Synonyms (.+-.)-Mammea B/BA cyclo E 5,7-Dihydroxy-8,8-dimethyl-10-(3-methylbutanoyl)-4-propyl-7,8-dihydro-2H,6H-pyrano[3,2-g]chromen-2-one Mammea b/ba cyclo E 3,5-Dihydroxy-2,2-dimethyl-10-(3-methyl-1-oxobutyl)-6-propyl-3,4-dihydropyrano[3,2-g][1]benzopyran-8-one 3,5-Dihydroxy-2,2-dimethyl-10-(3-methylbutanoyl)-6-propyl-3,4-dihydropyrano[3,2-g]chromen-8-one 2,2-Dimethyl-10-(3-methylbutanoyl)-3,5-bis(oxidanyl)-6-propyl-3,4-dihydropyrano[3,2-g]chromen-8-one
Wiley ID 1363869