input word = C00031680

Metabolite InformationStructural formula
Name Yopaaoside A
(-)-Yopaaoside A
Formula C27H28O15
Mw 592.14282023
CAS RN 442198-07-4
C_ID C00031680 ,
InChIKey KAKHKTCZSFQJKF-HTUROTOQNA-N
InChICode InChI=1S/C27H28O15/c1-36-13-5-9(3-4-12(13)29)17(30)10-6-27(42-24(10)35)16-15(21-22(27)40-21)11(23(34)37-2)8-38-25(16)41-26-20(33)19(32)18(31)14(7-28)39-26/h3-6,8,14-16,18-22,25-26,28-29,31-33H,7H2,1-2H3/t14-,15-,16-,18+,19+,20-,21+,22+,25+,26+,27+/m1/s1
SMILES O1C=C([C@@H]2[C@H]([C@@H]1O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)[C@@]1([C@@H]3[C@H]2O3)OC(=O)C(=C1)C(=O)c1cc(c(cc1)O)OC)C(=O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeMorinda citrifolia L. Ref.
PlantaeRubiaceaeMorinda coreia Ref.
PlantaeRubiaceaeMorinda elliptica Ref.
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OrganismMorinda coreia
ReferenceKanchanapoom,Phytochem.,59,(2002),551