input word = C00003490

Metabolite InformationStructural formula
Name Terpenoid EA-I
Formula C30H40O8
Mw 528.27231825
CAS RN 92219-48-2
C_ID C00003490 ,
InChIKey CZCPFHFUOUQBDL-GEMISIRMNA-N
InChICode InChI=1S/C30H40O8/c1-6-7-8-9-10-11-12-13-28-36-23-21-24-27(16-31,35-24)25(33)29(34)20(14-18(4)22(29)32)30(21,38-28)19(5)15-26(23,37-28)17(2)3/h10-14,19-21,23-25,31,33-34H,2,6-9,15-16H2,1,3-5H3/b11-10+,13-12+/t19-,20-,21-,23-,24+,25-,26-,27+,28?,29-,30+/m1/s1
SMILES [C@@H]12[C@]([C@@H]([C@@]3([C@H]([C@@H]4[C@@]51[C@@H](C[C@]1([C@@H]4O[C@@](O1)(O5)/C=C/C=C/CCCCC)C(=C)C)C)O3)CO)O)(C(=O)C(=C2)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeExcoecaria agallocha Ref.
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