input word = C00048975

Metabolite InformationStructural formula
Name Esulatin D
(-)-Esulatin D
Formula C32H44O13
Mw 636.27819149
CAS RN 209911-66-0
C_ID C00048975 ,
InChIKey OPQAEQYPBHCNDV-ZRDQHYCKNA-N
InChICode InChI=1S/C32H44O13/c1-16-12-13-30(9,10)25(41-19(4)34)14-24(40-18(3)33)17(2)27(42-20(5)35)26-29(43-21(6)36)31(11,44-22(7)37)15-32(26,28(16)39)45-23(8)38/h12-13,16,24-27,29H,2,14-15H2,1,3-11H3/b13-12-/t16-,24-,25-,26+,27+,29-,31-,32-/m1/s1
SMILES C=C1[C@H](OC(C)=O)C[C@@H](OC(C)=O)C(C)(C)/C=C[C@@H](C)C(=O)[C@@]2(OC(C)=O)C[C@@](C)(OC(C)=O)[C@H](OC(C)=O)[C@@H]2[C@H]1OC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeEuphorbia esula Ref.
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