| CAS Number | 60778-02-1 |
| Catalog Number | AG00EGMT(AGN-PC-0SXQBM) |
| Chemical Name | QUERCETIN-3-O-BETA-D-GLUCOSE-7-O-BETA-D-GENTIOBIOSIDE |
| IUPAC Name | 2-(3,4-dihydroxyphenyl)-5-hydroxy-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one |
| InChI | InChI=1S/C33H40O22/c34-6-15-19(39)23(43)26(46)31(52-15)49-8-17-21(41)25(45)27(47)32(54-17)50-10-4-13(38)18-14(5-10)51-29(9-1-2-11(36)12(37)3-9)30(22(18)42)55-33-28(48)24(44)20(40)16(7-35)53-33/h1-5,15-17,19-21,23-28,31-41,43-48H,6-8H2/t15-,16-,17-,19-,20-,21-,23+,24+,25+,26-,27-,28-,31-,32-,33+/m1/s1 |
| InChI Key | VUTMUSRYWYUQIK-GZIDCZEMSA-N |
| MDL Number | MFCD23379931 |
| Molecular Formula | C33H40O22 |
| Molecular Weight | 788.6575 |
| SMILES | O=C1C(O[C@@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)=C(C3=CC=C(O)C(O)=C3)OC4=C1C(O)=CC(O[C@H]5[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]6[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O6)O5)=C4 |
| Synonyms | 60778-02-1,
Quercetin 3-O-beta-D-glucose-7-O-beta-D-gentiobioside,
Quercetin-3-O-beta-D-glucose-7-O-beta-D-gentiobioside,
VUTMUSRYWYUQIK-GZIDCZEMSA-N,
ACN-047729,
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