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naphtopyrone YWA1

PropertiesImage
MNX_IDMNXM128792 Image of MNXM128792
referencechebi:133763
formulaC14H12O6
global charge0
mol weight276.244
InChIKeyRTYDQIKVNMHQMZ-UHFFFAOYSA-N
InChIInChI=1S/C14H12O6/c1-14(19)5-9(17)12-10(20-14)3-6-2-7(15)4-8(16)11(6)13(12)18/h2-4,15-16,18-19H,5H2,1H3
SMILESCC1(O)CC(=O)C2=C(O)C3=C(O)C=C(O)C=C3C=C2O1
MNX internals
InChI (mnx)InChI=1/C14H12O6/c1-14(19)5-9(17)12-10(20-14)3-6-2-7(15)4-8(16)11(6)13(12)18/h2-4,15-16,18-19H,5H2,1H3/t14? Image of MNXM128792
SMILES (mnx)[CH3:1][C:14]1([OH:19])[CH2:5][C:9](=[O:17])[C:12]2=[C:13]([OH:18])[C:11]3=[C:8]([OH:16])[CH:4]=[C:7]([OH:15])[CH:2]=[C:6]3[CH:3]=[C:10]2[O:20]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:133763
chebi:133763
RTYDQIKVNMHQMZ-UHFFFAOYSA-N 		naphtopyrone YWA1
2,5,6,8-tetrahydroxy-2-methyl-2,3-dihydro-4H-naphtho[2,3-b]pyran-4-one
O-Demethylfonsecin
YWA1
demethylfonsecin
desmethylfonsecin

seed.compound:cpd34971
seedM:cpd34971
RTYDQIKVNMHQMZ-UHFFFAOYSA-N 		2,5,6,8-tetrahydroxy-2-methyl-2H,3H,4H-naphtho[2,3-b]pyran-4-one
YWA1
hmdb:HMDB0033649
RTYDQIKVNMHQMZ-UHFFFAOYSA-N 		O-Demethylfonsecin
2,5,6,8-tetrahydroxy-2-methyl-2H,3H,4H-naphtho[2,3-b]pyran-4-one
2,5,6,8-tetrahydroxy-2-methyl-3H-naphtho[2,3-b]pyran-4-one
De-O-methylfonsecin
Demethylfonsecin
Desmethylfonsecin
YWA 1

metacyc.compound:CPD-18255
metacycM:CPD-18255
RTYDQIKVNMHQMZ-UHFFFAOYSA-N 		YWA1
2,5,6,8-tetrahydroxy-2-methyl-2H,3H,4H-naphtho[2,3-b]pyran-4-one

hmdb:HMDB33649
seedM:M_cpd34971 		secondary/obsolete/fantasy identifier