input word = C00062737

Metabolite InformationStructural formula
Name 1,6-Cyclodecadiene
Formula C27H28N4O4S
Mw 504.18312614
CAS RN 7049-13-0
C_ID C00062737
InChIKey PQTWHJRDPOWUHD-UHFFFAOYSA-N
InChICode InChI=1S/C27H28N4O4S/c1-18-25(36-26(29-18)19-7-3-2-4-8-19)23(32)21-22(20-9-5-10-28-17-20)31(27(34)24(21)33)12-6-11-30-13-15-35-16-14-30/h2-5,7-10,17,22,33H,6,11-16H2,1H3
SMILES Cc1nc(-c2ccccc2)sc1C(=O)C1=C(O)C(=O)N(CCCN2CCOCC2)C1c1cccnc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataePerilla frutescens Ref.
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