input word = C00057679

Metabolite InformationStructural formula
Name Nonioside F
Formula C28H50O17
Mw 658.30480017
CAS RN 944746-18-3
C_ID C00057679
InChIKey HCLQGOMLWNZMTI-BIJJWMFMSA-N
InChICode InChI=1S/C28H50O17/c1-2-3-4-5-6-7-8-9-16(31)44-28-25(45-27-24(39)21(36)18(33)14(11-30)42-27)22(37)19(34)15(43-28)12-40-26-23(38)20(35)17(32)13(10-29)41-26/h13-15,17-30,32-39H,2-12H2,1H3/t13-,14-,15-,17-,18-,19-,20+,21+,22+,23-,24+,25-,26-,27+,28+/m1/s1
SMILES O[C@@H]1[C@@H](O)[C@H](OC[C@@H]2[C@@H](O)[C@H](O)[C@@H](O[C@H]3[C@@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)[C@H](OC(CCCCCCCCC)=O)O2)O[C@H](CO)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeMorinda citrifolia Ref.
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OrganismMorinda citrifolia
ReferenceTemeriusz, A. et al., Pol. J. Chem. (Rocz. Chem.), 1982, 56, 141 (alpha-Me gly synth)