(+)-Maackiain

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Systematic / IUPAC Name: (6aS,12aS)-6a,12a-Dihydro-6H-[1,3]dioxolo[5,6][1]benzofuro[3,2-c]chromen-3-ol

ID: Reference3430

Other Names: 6a,12a-Dihydro-6H-(1,3)dioxolo(5,6)benzofuro(3,2-c)(1)benzopyran-3-ol;
Demethylpterocarpin

Formula: C16H12O5

Class: Endogenous Metabolites

Spectral Data

(+)-Maackiain 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 Elite
No. of Spectral Trees 1
No. of Spectra 1495
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers IT; FT
Last Modification 11/26/2015 12:41:36 PM
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Identificators

InChI InChI=1S/C16H12O5/c17-8-1-2-9-12(3-8)18-6-11-10-4-14-15(20-7-19-14)5-13(10)21-16(9)11/h1-5,11,16-17H,6-7H2/t11-,16-/m1/s1
InChI Key HUKSJTUUSUGIDC-BDJLRTHQSA-N
Canonical SMILES C1C2C(C3=C(O1)C=C(C=C3)O)OC4=CC5=C(C=C24)OCO5
CAS
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Other Names 6a,12a-Dihydro-6H-(1,3)dioxolo(5,6)benzofuro(3,2-c)(1)benzopyran-3-ol;
Demethylpterocarpin

In Other Databases

ChemIDPlus 019908486
KEGG C16229
ChemSpider 141688
PubChem 161298
ChEBI CHEBI:73030