| Name |
Praecoxin B |
| Formula |
C34H26O22 |
| Mw |
786.09157252 |
| CAS RN |
86154-09-8 |
| C_ID |
C00035373
, 
|
| InChIKey |
JUSIDEHFVDFXNU-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C34H26O22/c35-7-20-30(56-34(52)12-6-18(41)26(46)28(48)22(12)21-11(33(51)54-20)5-17(40)25(45)27(21)47)29(55-32(50)10-3-15(38)24(44)16(39)4-10)19(42)8-53-31(49)9-1-13(36)23(43)14(37)2-9/h1-7,19-20,29-30,36-48H,8H2/t19-,20-,29+,30-/m0/s1 |
| SMILES |
O=CC1OC(=O)c2cc(O)c(O)c(O)c2-c2c(cc(O)c(O)c2O)C(=O)OC1C(OC(=O)c1cc(O)c(O)c(O)c1)C(O)COC(=O)c1cc(O)c(O)c(O)c1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Melastomataceae | Tibouchina semidecandra | Ref. |
|
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