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Artobiloxanthone

PropertiesImage
MNX_IDMNXM1107315 Image of MNXM1107315
referencehmdb:HMDB0034021
formulaC25H22O7
global charge0
mol weight434.444
InChIKeyZIYAGIMFLYOZDS-UHFFFAOYSA-N
InChIInChI=1S/C25H22O7/c1-10(2)12-7-13-21(29)20-15(27)9-17-11(5-6-25(3,4)32-17)23(20)31-24(13)19-14(26)8-16(28)22(30)18(12)19/h5-6,8-9,12,26-28,30H,1,7H2,2-4H3
SMILESC=C(C)C1CC2=C(OC3=C(C2=O)C(O)=CC2=C3C=CC(C)(C)O2)C2=C(O)C=C(O)C(O)=C21
MNX internals
InChI (mnx)InChI=1/C25H22O7/c1-10(2)12-7-13-21(29)20-15(27)9-17-11(5-6-25(3,4)32-17)23(20)31-24(13)19-14(26)8-16(28)22(30)18(12)19/h5-6,8-9,12,26-28,30H,1,7H2,2-4H3/t12? Image of MNXM1107315
SMILES (mnx)[CH2:1]=[C:10]([CH3:2])[CH:12]1[CH2:7][C:13]2=[C:24]([C:19]3=[C:14]([OH:26])[CH:8]=[C:16]([OH:28])[C:22]([OH:30])=[C:18]13)[O:31][C:23]1=[C:20]([C:15]([OH:27])=[CH:9][C:17]3=[C:11]1[CH:5]=[CH:6][C:25]([CH3:3])([CH3:4])[O:32]3)[C:21]2=[O:29]
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
hmdb:HMDB0034021
ZIYAGIMFLYOZDS-UHFFFAOYSA-N 		Artobiloxanthone
1-(2-Hydroxyphenyl)propane
1-Hydroxy-2-N-propylbenzene
1-Hydroxy-2-propylbenzene
11,18,19,21-tetrahydroxy-7,7-dimethyl-16-(prop-1-en-2-yl)-2,8-dioxapentacyclo[12.8.0.0³,¹².0⁴,⁹.0¹⁷,²²]docosa-1(14),3(12),4(9),5,10,17(22),18,20-octaen-13-one
2-N-Propylphenol
2-Propyl-phenol
8,9-dihydro-6,10,11,13-Tetrahydroxy-3,3-dimethyl-9-(1-methylethenyl)-3H,7H-benzo[c]pyrano[3,2-H]xanthen-7-one, 9ci
FEMA 3522
KB 1
O-N-Propylphenol
O-Propyl-phenol
O-Propylphenol

hmdb:HMDB34021 		secondary/obsolete/fantasy identifier