Name |
Isorhamnetin 3-[2''-(4'''-acetylrhamnosyl)-gentiobioside] Quercetin 3'-methyl ether 3-[2''-(4'''-acetylrhamnosyl)-gentiobioside] 3-[(O-4-O-Acetyl-6-deoxy-alpha-L-mannopyranosyl-(1->2)-O-[beta-D-glucopyranosyl-(1->6)]-beta-D-glucopyranosyl)oxy]-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-1-benzopyran-4-one |
Formula |
C36H44O22 |
Mw |
828.23242309 |
CAS RN |
220716-16-5 |
C_ID |
C00013924
,
|
InChIKey |
VJEVXTUVNQQJJL-OQUKFHNFNA-N |
InChICode |
InChI=1S/C36H44O22/c1-11-30(53-12(2)38)27(47)29(49)35(52-11)58-33-26(46)23(43)20(10-51-34-28(48)25(45)22(42)19(9-37)55-34)56-36(33)57-32-24(44)21-16(41)7-14(39)8-18(21)54-31(32)13-4-5-15(40)17(6-13)50-3/h4-8,11,19-20,22-23,25-30,33-37,39-43,45-49H,9-10H2,1-3H3/t11-,19+,20+,22+,23+,25-,26-,27+,28+,29-,30-,33+,34+,35-,36-/m0/s1 |
SMILES |
c1c(cc(c(c1)O)OC)c1oc2c(c(=O)c1O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)O)O[C@H]1[C@H]([C@H]([C@H]([C@@H](O1)C)OC(=O)C)O)O)c(cc(c2)O)O |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Apiaceae | Ammi majus | Ref. |
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