| Name |
Cyanidin 3-O-[beta-D-glucopyranoside]-7,3'-di-O-[6-O-(sinapyl)-beta-D-glucopyranoside] |
| Formula |
C55H61O29 |
| Mw |
1185.32985099 |
| CAS RN |
190279-20-0 |
| C_ID |
C00011095
, 
|
| InChIKey |
XOYAXTMVHJXJIK-FPVCVJLNNA-O |
| InChICode |
InChI=1S/C55H60O29/c1-72-31-11-22(12-32(73-2)41(31)61)5-9-39(59)76-20-37-44(64)47(67)49(69)53(83-37)78-25-16-28(58)26-18-35(81-55-50(70)46(66)43(63)36(19-56)82-55)52(79-29(26)17-25)24-7-8-27(57)30(15-24)80-54-51(71)48(68)45(65)38(84-54)21-77-40(60)10-6-23-13-33(74-3)42(62)34(14-23)75-4/h5-18,36-38,43-51,53-56,63-71H,19-21H2,1-4H3,(H3-,57,58,59,60,61,62)/p+1/t36-,37+,38-,43-,44-,45-,46+,47+,48-,49-,50+,51-,53-,54-,55-/m1/s1 |
| SMILES |
COc1cc(/C=C/C(=O)OCC2O[C@@H](Oc3cc(O)c4cc(O[C@@H]5O[C@H](CO)[C@@H](O)C(O)C5O)c(-c5ccc(O)c(O[C@@H]6O[C@H](COC(=O)/C=C/c7cc(OC)c(O)c(OC)c7)[C@@H](O)C(O)C6O)c5)[o+]c4c3)C(O)[C@@H](O)[C@@H]2O)cc(OC)c1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Orchidaceae | Dendrobium spp. | Ref. |
| Plantae | Orchidaceae | Phalaenopsis equestris | Ref. |
| Plantae | Orchidaceae | Phalaenopsis leucorrhoda | Ref. |
| Plantae | Orchidaceae | Phalaenopsis sanderiana | Ref. |
| Plantae | Orchidaceae | Phalaenopsis schilleriana | Ref. |
| Plantae | Orchidaceae | Phalaenopsis x intermedia | Ref. |
| Plantae | Orchidaceae | Vanda spp. | Ref. |
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