| 2D Structure | |
| CID | 5481663 |
| Target | Pparg , Prkaa2 |
| IUPAC Name | 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one |
| InChI | InChI=1S/C28H32O16/c1-9-18(32)21(35)23(37)27(41-9)40-8-16-19(33)22(36)24(38)28(43-16)44-26-20(34)17-13(31)6-11(29)7-15(17)42-25(26)10-3-4-12(30)14(5-10)39-2/h3-7,9,16,18-19,21-24,27-33,35-38H,8H2,1-2H3/t9-,16+,18-,19+,21+,22-,23+,24+,27+,28-/m0/s1 |
| InChI Key | UIDGLYUNOUKLBM-GEBJFKNCSA-N |
| Canonical SMILES | CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)OC)O)O)O)O)O)O |
| Isomeric SMILES | C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)OC)O)O)O)O)O)O |
| Molecular Formula | C28H32O16 |
| Molecular Weight | 624.5 |
| synonyms | ['Narcissoside', 'Narcissin', '604-80-8', 'Isorhamnetin 3-rutinoside', 'Narcissin Flavonol', 'Isorhamnetin 3-rhamnoglucoside', 'UNII-N4AX11L1TF', 'N4AX11L1TF', '3-O-RUTINOSYLISORHAMNETIN', 'DTXSID00209157', "3'-O-METHYLQUERCETIN 3-RUTINOSIDE", '4H-1-Benzopyran-4-one, 3-((6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-', '4H-Benzopyran-4-one, 3-((6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-', 'ISORHAMNETIN-3-O-RUTINOSIDE (USP-RS)', 'ISORHAMNETIN-3-O-RUTINOSIDE [USP-RS]', 'DTXCID20131648', 'ISORHAMNETIN 3-beta-O-RUTINOSIDE', 'ISORHAMNETIN 3-O-beta-RUTINOSIDE', 'ISORHAMNETIN-3-O-RUTINOSIDE (CONSTITUENT OF GINKGO)', '4H-1-BENZOPYRAN-4-ONE, 3-996-O-(6-DEOXY-alpha-L-MANNOPYRANOSYL)-beta-D-GLUCOPYRANOSYL)OXY)-5,7-DIHYDROXY-2-(4-HYDROXY-3-METHOXYPHENYL)-', 'Isorhamnetin 3-O-rutinoside', 'Isprhamnetin-3-rutinoside', 'Isorhamnetin-3-O-rutinoside', 'C28H32O16', '5,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-((((2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one', 'Isorhamnetin-3-O-beta-D-rutinoside', '4H-1-Benzopyran-4-one,3-[[6-O-(6-deoxy-a-L-mannopyranosyl)-b-D-glucopyranosyl]oxy]-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-', '5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one', 'Isorhamnetin-3-rutinoside', 'MFCD00017734', 'Narcissin (Standard)', 'CHEMBL258394', 'SCHEMBL7167500', 'HY-N0649R', 'CHEBI:145096', 'UIDGLYUNOUKLBM-GEBJFKNCSA-N', 'HY-N0649', 'BDBM50379284', 'MSK161757', 's9423', 'AKOS030632878', 'Isorhamnetin-3-rutinoside;Narcissoside', 'CCG-270266', 'FN65311', 'AC-34730', 'AS-75139', '1ST161757', 'ISORHAMNETIN 3-.BETA.-O-RUTINOSIDE', 'ISORHAMNETIN 3-O-.BETA.-RUTINOSIDE', 'CS-0009675', 'ISORHAMENTIN-3-O-.BETA.-D-RUTINOSIDE', 'C16060', 'Q23418564', 'ISORHAMNETIN-3-O-RUTINOSIDE (CONSTITUENT OF GINKGO) [DSC]', 'ISORHAMNETIN 3-O-.BETA.-D-(6-O-.ALPHA.-L-RHAMNOSYL)GLUCOSIDE', '4H-1-BENZOPYRAN-4-ONE, 3-996-O-(6-DEOXY-.ALPHA.-L-MANNOPYRANOSYL)-.BETA.-D-GLUCOPYRANOSYL)OXY)-5,7-DIHYDROXY-2-(4-HYDROXY-3-METHOXYPHENYL)-', '5,7-dihydroxy-2-(4-hydroxy-3-methoxy-phenyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2-yl]oxy-chromen-4-one', '5,7-Dihydroxy-2-(4-hydroxy-3-methoxy-phenyl)-3-[3,4,5-trihydroxy-6-(3,4,5-trihydroxy-6-methyl-tetrahydro-pyran-2-yloxymethyl)-tetrahydro-pyran-2-yloxy]-1-benzopyran-4-one', '5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-4H-chromen-4-one'] |
From Pubchem