input word = C00002617

Metabolite InformationStructural formula
Name Phrymarolin I
Formula C24H24O11
Mw 488.13186161
CAS RN 38303-95-6
C_ID C00002617 ,
InChIKey ZGBQEJGNORPNKC-PWNOOFOSNA-N
InChICode InChI=1S/C24H24O11/c1-12(25)35-24-9-29-22(13-4-17-18(31-10-30-17)5-15(13)26-2)14(24)8-28-23(24)34-21-7-20-19(32-11-33-20)6-16(21)27-3/h4-7,14,22-23H,8-11H2,1-3H3/t14-,22-,23+,24-/m1/s1
SMILES [C@@H]12[C@@]([C@@H](OC1)Oc1cc3c(cc1OC)OCO3)(CO[C@@H]2c1cc2c(cc1OC)OCO2)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePhrymaceaePhryma leptostachya Ref.
--Sparanskia tuberculata Ref.
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OrganismSparanskia tuberculata
ReferenceSun, et al., Brief Handbook of Natural Active Compounds, Medicinal Science and Technology Press of China, Beijing, (1998).

Karikome, Wen-ben Yang translated, Phytochemistry, Science Press, Beijing, (1985)