input word = C00045922

Metabolite InformationStructural formula
Name Erlangerin A
(+)-Erlangerin A
Formula C27H28O11
Mw 528.16316174
CAS RN 465535-61-9
C_ID C00045922 ,
InChIKey YZRDGLILUWSIQK-KHXXHKHSNA-N
InChICode InChI=1S/C27H28O11/c1-6-13(2)24(28)38-23-15-10-18(32-3)21(33-4)22(34-5)19(15)20(27(31)25(29)35-11-26(23,27)30)14-7-8-16-17(9-14)37-12-36-16/h6-10,20,23,30-31H,11-12H2,1-5H3/b13-6-/t20-,23-,26-,27-/m1/s1
SMILES C(=C(\C(=O)O[C@H]1[C@]2([C@](C(=O)OC2)([C@@H](c2c1cc(c(c2OC)OC)OC)c1ccc2c(c1)OCO2)O)O)/C)\C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBurseraceaeCommiphora erlangeriana Ref.
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