input word = C00035559

Metabolite InformationStructural formula
Name Cerleaside A
Formula C30H44O8
Mw 532.30361838
CAS RN 111534-97-5
C_ID C00035559 ,
InChIKey SWTJRDUVJNXNMX-UHFFFAOYNA-N
InChICode InChI=1S/C30H44O8/c1-16-23(32)25(35-4)24(33)26(37-16)38-19-6-9-28(2)18(14-19)5-11-30-12-7-20(17-13-22(31)36-15-17)29(3,27(30)34)10-8-21(28)30/h13,16,18-21,23-26,32-33H,5-12,14-15H2,1-4H3/t16-,18-,19-,20+,21+,23-,24-,25+,26+,28+,29+,30+/m1/s1
SMILES C1(=O)[C@@]2([C@@H](CC[C@]31[C@@H](CC2)[C@@]1([C@H](CC3)C[C@@H](CC1)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C)O)OC)O)C)C1=CC(=O)OC1)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeCerbera adollam Ref.
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