versiconol acetate
Chemical Formula:
C20H16O9
Molecular Weight:
400.341 Daltons
Monoisotopic Mass:
402.0950821767 Daltons
SMILES:
CC(=O)OCCC(C1(=C([O-])C=C2(C(=C(O)1)C(=O)C3(=C(C(=O)2)C=C([O-])C=C(O)3))))CO
InChI:
1S/C20H18O9/c1-8(22)29-3-2-9(7-21)15-14(25)6-12-17(19(15)27)20(28)16-11(18(12)26)4-10(23)5-13(16)24/h4-6,9,21,23-25,27H,2-3,7H2,1H3/p-2
InChIKey:
Synonyms
- 9,10-anthracenedione, 2-(3-(acetyloxy)-1-(hydroxymethyl)propyl)-1,3,6,8-tetrahydroxy-, (-)-
- (3S)-4-hydroxy-3-[1,3,6,8-tetrahydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl]butyl acetate
Databases
MetaCyc:
CPD-10172
ChEBI:
71636
PubChem (CID):
25200595
Seed:
cpd22592
MetaNetX:
MNXM9230
KEGG:
C20506