input word = C00032588

Metabolite InformationStructural formula
Name 1,3-Dihydroxy-2-carbomethoxy-9,10-anthraquinone 3-O-beta-primeveroside
Formula C26H26O15
Mw 578.12717016
CAS RN 470704-06-4
C_ID C00032588 ,
InChIKey NXCMDLYYNZCRPP-AEDAZNLFNA-N
InChICode InChI=1S/C26H26O15/c27-11-6-38-25(22(34)18(11)30)39-7-13-19(31)21(33)23(35)26(41-13)40-12-5-10-14(20(32)15(12)24(36)37)17(29)9-4-2-1-3-8(9)16(10)28/h1-5,11,13,18-19,21-23,25-27,30-35H,6-7H2,(H,36,37)/t11-,13+,18-,19-,21-,22-,23+,25+,26+/m0/s1
SMILES c12c(C(=O)c3c(C1=O)cc(c(c3O)C(=O)O)O[C@@H]1O[C@@H]([C@@H]([C@@H]([C@H]1O)O)O)CO[C@@H]1[C@H]([C@H]([C@H](CO1)O)O)O)cccc2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeSaprosma scortechinii Ref.
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