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globosuxanthone B

PropertiesImage
MNX_IDMNXM105383 Image of MNXM105383
referencechebi:68713
formulaC16H16O8
global charge0
mol weight336.296
InChIKeyDKCFLWCWQILBFZ-DRZCJDIDSA-N
InChIInChI=1S/C16H16O8/c1-22-10-6-9-12(16(21,14(10)19)15(20)23-2)13(18)11-7(17)4-3-5-8(11)24-9/h3-5,10,14,17,19,21H,6H2,1-2H3/t10-,14+,16+/m0/s1
SMILESCOC(=O)[C@@]1(O)C2=C(C[C@H](OC)[C@H]1O)OC1=CC=CC(O)=C1C2=O
MNX internals
InChI (mnx)InChI=1/C16H16O8/c1-22-10-6-9-12(16(21,14(10)19)15(20)23-2)13(18)11-7(17)4-3-5-8(11)24-9/h3-5,10,14,17,19,21H,6H2,1-2H3/t10-,14+,16+/m0/s1 Image of MNXM105383
SMILES (mnx)[CH3:1][O:22][C@H:10]1[CH2:6][C:9]2=[C:12]([C:13](=[O:18])[C:11]3=[C:7]([OH:17])[CH:4]=[CH:3][CH:5]=[C:8]3[O:24]2)[C@@:16]([C:15](=[O:20])[O:23][CH3:2])([OH:21])[C@@H:14]1[OH:19]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:68713
chebi:68713
DKCFLWCWQILBFZ-DRZCJDIDSA-N
globosuxanthone B
1R*,2R*,8-trihydroxy-3S*-methoxy-1,2,3,4-tetrahydroxanthenone-1-carboxylic acid ester
rel-methyl (1R,2R,3S)-1,2,8-trihydroxy-3-methoxy-9-oxo-2,3,4,9-tetrahydro-1H-xanthene-1-carboxylate