| Name |
Newbouldioside C
(-)-Newbouldioside C |
| Formula |
C46H56O23 |
| Mw |
976.3212381 |
| CAS RN |
886855-59-0 |
| C_ID |
C00034944
, 
|
| InChIKey |
SVNIIMYPSPJPRI-UQWRMPQTNA-N |
| InChICode |
InChI=1S/C46H56O23/c1-22-35(53)38(56)41(68-45-42(58)46(20-47,21-64-45)69-34(52)12-7-23-6-10-27(49)29(16-23)59-2)44(65-22)67-40-39(57)37(55)32(66-43(40)62-14-13-24-5-9-26(48)28(50)15-24)19-63-33(51)11-8-25-17-30(60-3)36(54)31(18-25)61-4/h5-12,15-18,22,32,35,37-45,47-50,53-58H,13-14,19-21H2,1-4H3/b11-8+,12-7+/t22-,32+,35-,37+,38+,39-,40+,41-,42-,43+,44-,45-,46+/m0/s1 |
| SMILES |
COc1cc(/C=C/C(=O)O[C@]2(CO)CO[C@@H](OC3[C@H](O[C@H]4[C@H](OCCc5ccc(O)c(O)c5)O[C@H](COC(=O)/C=C/c5cc(OC)c(O)c(OC)c5)[C@@H](O)[C@@H]4O)O[C@@H](C)[C@H](O)[C@H]3O)[C@@H]2O)ccc1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Bignoniaceae | Newbouldia laevis  | Ref. |
|
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