input word = C00010736

Metabolite InformationStructural formula
Name Oruwacin
Formula C21H18O8
Mw 398.10016755
CAS RN 70368-12-6
C_ID C00010736 ,
InChIKey TXGZCLZZWWAVDP-YPBFAHMENA-N
InChICode InChI=1S/C21H18O8/c1-25-15-8-10(3-4-14(15)22)7-12-17-21(29-19(12)24)6-5-11-13(18(23)26-2)9-27-20(28-17)16(11)21/h3-9,11,16-17,20,22H,1-2H3/b12-7+/t11-,16+,17?,20+,21+/m0/s1
SMILES COC(=O)C1=CO[C@@H]2OC3/C(=Cc4ccc(O)c(OC)c4)C(=O)O[C@]34C=C[C@H]1[C@H]24
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeMorinda lucida Ref.
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OrganismMorinda lucida
ReferenceAdesogan, Phytochem.,18,(1979),175