input word = C00038779

Metabolite InformationStructural formula
Name Circinasine A
Formula C23H37NO7
Mw 439.25700254
CAS RN 939972-75-5
C_ID C00038779 ,
InChIKey XZMQBOLTQNBOEK-UHFFFAOYNA-N
InChICode InChI=1S/C23H37NO7/c1-4-24-10-19(11-30-2)6-5-15(31-3)23-12-7-21(28)14(25)9-20(27,16(12)18(21)26)13(17(23)24)8-22(19,23)29/h12-18,25-29H,4-11H2,1-3H3/t12-,13-,14-,15-,16-,17+,18-,19-,20+,21+,22-,23+/m1/s1
SMILES [C@H]12[C@@H]3N(C[C@@]4([C@@]([C@@]3([C@@H]3C[C@@]5([C@@H](C[C@]2([C@H]3[C@H]5O)O)O)O)[C@@H](CC4)OC)(C1)O)COC)CC
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Cholesterol
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeAconitum hemsleyanum var.circinatum Ref.
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