input word = C00038785

Metabolite InformationStructural formula
Name Circinasine G
Formula C30H39NO10
Mw 573.25739647
CAS RN 939972-81-3
C_ID C00038785 ,
InChIKey JAKGTNJMCMRBLS-PCBMNDLNNA-N
InChICode InChI=1S/C30H39NO10/c1-37-14-26-13-31-23-18-11-29(26,36)30(23,20(39-3)9-19(26)32)17-10-28(35)21(40-4)12-27(18,34)22(17)24(28)41-25(33)15-5-7-16(38-2)8-6-15/h5-8,13,17-24,32,34-36H,9-12,14H2,1-4H3/t17-,18+,19-,20+,21+,22-,23-,24-,26+,27+,28+,29+,30-/m1/s1
SMILES COC[C@]12C=NC3C4C[C@@]1(O)C3([C@@H](OC)C[C@H]2O)[C@@H]1C[C@]2(O)[C@@H](OC)C[C@@]4(O)[C@H]1[C@H]2OC(=O)c1ccc(OC)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeAconitum hemsleyanum var.circinatum Ref.
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