input word = C00045276

Metabolite InformationStructural formula
Name Dalmaisione C
(-)-Dalmaisione C
Formula C28H28O14
Mw 588.14790561
CAS RN 418809-66-2
C_ID C00045276 ,
InChIKey QNLOOUJRSPWZGX-YZLNZWDENA-N
InChICode InChI=1S/C28H28O14/c1-10-17(30)20(33)22(35)27(37-10)42-25-21(34)19(32)15(9-29)40-28(25)39-14-8-4-6-12-18(31)16-24(41-23(12)14)11-5-2-3-7-13(11)38-26(16)36/h2-8,10,15,17,19-22,25,27-30,32-35H,9H2,1H3/t10-,15+,17-,19+,20+,21-,22+,25+,27-,28+/m0/s1
SMILES c1ccc2c(c1O[C@H]1[C@H](O[C@@H]3O[C@H]([C@@H]([C@H]([C@H]3O)O)O)C)[C@H]([C@@H]([C@H](O1)CO)O)O)oc1c(c2=O)c(=O)oc2c1cccc2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePolygalaceaePolygala dalmaisiana Ref.
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OrganismPolygala dalmaisiana
ReferenceKobayashi,J.Nat.Prod.,65,(2002),319