input word = C00042564

Metabolite InformationStructural formula
Name Glomeratose A
Formula C24H34O15
Mw 562.18977042
CAS RN 202471-84-9
C_ID C00042564 ,
InChIKey PQHNJDATPYXLIX-AXPVOBRFNA-N
InChICode InChI=1S/C24H34O15/c1-33-12-6-11(7-13(34-2)21(12)35-3)4-5-16(28)37-22-18(30)15(9-26)38-24(22,10-27)39-23-20(32)19(31)17(29)14(8-25)36-23/h4-7,14-15,17-20,22-23,25-27,29-32H,8-10H2,1-3H3/b5-4+/t14-,15-,17-,18-,19+,20-,22-,23-,24+/m1/s1
SMILES c1(cc(c(c(c1)OC)OC)OC)/C=C/C(=O)O[C@H]1[C@](O[C@@H]([C@H]1O)CO)(CO)O[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeRauwolfia serpentina Ref.
PlantaePolygalaceaePolygala glomerata Ref.
PlantaePolygalaceaePolygala sibirica Ref.
PlantaePolygalaceaePolygala tricornis Ref.
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OrganismPolygala sibirica
ReferenceMiyase,J.Nat.Prod.,62,(1999),993