input word = C00038390

Metabolite InformationStructural formula
Name Aglinin A
Formula C30H50O5
Mw 490.36582471
CAS RN 246868-97-3
C_ID C00038390 ,
InChIKey UTPZDJKEZVYWGA-RXYGCSRVNA-N
InChICode InChI=1S/C30H50O5/c1-19(2)20-11-16-28(7)23(26(20,5)14-13-24(31)32)10-9-21-22(12-15-27(21,28)6)29(8)17-18-30(34,35-29)25(3,4)33/h20-23,33-34H,1,9-18H2,2-8H3,(H,31,32)/t20-,21+,22-,23+,26+,27+,28+,29-,30-/m0/s1
SMILES [C@]12([C@H](CC[C@H]3[C@]1(CC[C@H]([C@]3(CCC(=O)O)C)C(=C)C)C)[C@H](CC2)[C@]1(O[C@@](CC1)(C(C)(O)C)O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeAglaia lawii Ref.
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