input word = C00032582

Metabolite InformationStructural formula
Name 1,3,6-Trihydroxy-2-hydroxymethyl-9,10-anthraquinone 3-O-beta-primeveroside
Formula C26H28O15
Mw 580.14282023
CAS RN 470704-09-7
C_ID C00032582 ,
InChIKey SWVHEMRKGGBKIZ-RTGUQCDINA-N
InChICode InChI=1S/C26H28O15/c27-5-12-14(4-11-16(19(12)32)18(31)9-2-1-8(28)3-10(9)17(11)30)40-26-24(37)22(35)21(34)15(41-26)7-39-25-23(36)20(33)13(29)6-38-25/h1-4,13,15,20-29,32-37H,5-7H2/t13-,15-,20-,21-,22+,23-,24-,25+,26-/m1/s1
SMILES O=C1c2cc(O)ccc2C(=O)c2c1cc(O[C@@H]1O[C@H](COC3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]1O)c(CO)c2O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeSaprosma scortechinii Ref.
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