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6-hydroxy-2-(6-oxo-1-oxaspiro[2.5]octa-4,7-dien-2-yl)-1-benzofuran-3-one
MNXM12631 is deprecated and here replaced by MNXM727634
!!! Alternative mappings exist !!!
| Properties | Image |
MNX_ID | MNXM727634 |
 |
reference | metacycM:CPD-12036 |
formula | C15H10O5 |
global charge | 0 |
mol weight | 270.24 |
InChIKey | TYTGARXNZIJWFO-UHFFFAOYSA-N |
InChI | InChI=1S/C15H10O5/c16-8-3-5-15(6-4-8)14(20-15)13-12(18)10-2-1-9(17)7-11(10)19-13/h1-7,13-14,17H |
SMILES | O=C1C=CC2(C=C1)OC2C1OC2=CC(O)=CC=C2C1=O |
MNX internals
InChI (mnx) | InChI=1/C15H10O5/c16-8-3-5-15(6-4-8)14(20-15)13-12(18)10-2-1-9(17)7-11(10)19-13/h1-7,13-14,17H/t13?,14? |
 |
SMILES (mnx) | [CH:1]1=[CH:2][C:10]2=[C:11]([CH:7]=[C:9]1[OH:17])[O:19][CH:13]([CH:14]1[C:15]3([CH:5]=[CH:3][C:8](=[O:16])[CH:4]=[CH:6]3)[O:20]1)[C:12]2=[O:18] |
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Parent-child relations graph |
Occurences in reactions | #reac |
in my sandbox |
0 |
in MNXref (generic) | 3 |
in models (compartimentalized) |
0 |
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Similar chemical compounds in external resources
Identifier | Description |
metacyc.compound:CPD-12036 metacycM:CPD-12036 TYTGARXNZIJWFO-UHFFFAOYSA-N
| 6-hydroxy-2-(6-oxo-1-oxaspiro[2.5]octa-4,7-dien-2-yl)-1-benzofuran-3-one phenoxy radical VII
|
seed.compound:cpd23204 seedM:cpd23204 TYTGARXNZIJWFO-UHFFFAOYSA-N
| phenoxy radical VII 6-hydroxy-2-(6-oxo-1-oxaspiro[2.5]octa-4,7-dien-2-yl)-1-benzofuran-3-one
|
seedM:M_cpd23204
| secondary/obsolete/fantasy identifier
|