input word = C00035699

Metabolite InformationStructural formula
Name Netzahualcoyone
Formula C30H36O6
Mw 492.25118888
CAS RN 87686-36-0
C_ID C00035699 ,
InChIKey JBKXDADFFNVBTG-UHFFFAOYNA-N
InChICode InChI=1S/C30H36O6/c1-15-13-29(5)21(14-30(6,26(35)36-7)25(34)24(29)33)28(4)11-10-27(3)18(22(15)28)9-8-17-16(2)23(32)20(31)12-19(17)27/h8-9,12,21,25,32,34H,10-11,13-14H2,1-7H3/t21-,25+,27-,28+,29+,30+/m0/s1
SMILES C1(=O)C(=C(C2=CC=C3[C@@](C2=C1)(CC[C@]1(C3=C(C[C@@]2([C@H]1C[C@]([C@@H](C2=O)O)(C(=O)OC)C)C)C)C)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeCheiloclinium cognatum Ref.
PlantaeCelastraceaeSalacia campestris Ref.
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