(7E,13E)-9,15-Dihydroxy-4,10,16-trimethyl-1,5,11-trioxacyclohexadeca-7,13-diene-2,6,12-trione

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Systematic / IUPAC Name: (7E,13E)-9,15-Dihydroxy-4,10,16-trimethyl-1,5,11-trioxacyclohexadeca-7,13-diene-2,6,12-trione

ID: Reference7542

Other Names: Macrosphelide D;
1,5,11-Trioxacyclohexadeca-7,13-diene-2,6,12-trione, 9,15-dihydroxy-4,10,16-trimethyl-, (7E,13E)-

Formula: C16H22O8

Spectral Data

(7E,13E)-9,15-Dihydroxy-4,10,16-trimethyl-1,5,11-trioxacyclohexadeca-7,13-diene-2,6,12-trione mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 87
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 3/14/2018 12:15:30 PM
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Identificators

InChI InChI=1S/C16H22O8/c1-9-8-16(21)24-11(3)13(18)5-7-15(20)23-10(2)12(17)4-6-14(19)22-9/h4-7,9-13,17-18H,8H2,1-3H3/b6-4+,7-5+
InChI Key MJMMUATWVTYSFD-YDFGWWAZSA-N
Canonical SMILES CC1CC(=O)OC(C(C=CC(=O)OC(C(C=CC(=O)O1)O)C)O)C
CAS
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Other Names Macrosphelide D;
1,5,11-Trioxacyclohexadeca-7,13-diene-2,6,12-trione, 9,15-dihydroxy-4,10,16-trimethyl-, (7E,13E)-

In Other Databases

ChemSpider 8744678
PubChem 10569291