input word = C00055300

Metabolite InformationStructural formula
Name Cincassiol B
Formula C20H32O8
Mw 400.209718
CAS RN 73599-13-0
C_ID C00055300
InChIKey LIGPZBKBGCJTGC-VSDDQSBZSA-N
InChICode InChI=1S/C20H32O8/c1-10-5-6-16(24)13(3)8-18(26)14(4)15(23,11(2)7-21)9-17(13,25)20(14,27)19(16,28-18)12(10)22/h10-12,21-27H,5-9H2,1-4H3/t10-,11?,12+,13-,14+,15-,16-,17+,18-,19+,20+/m0/s1
SMILES CC(CO)[C@@]1(O)C[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5([C@H](O)[C@@H](C)CC[C@]35O)[C@@]2(O)[C@@]41C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLauraceaeCinnamomum cassia Ref.
zoom in



OrganismCinnamomum cassia
ReferenceSrivastava, S.N. et al., Acta Cryst. B, 1970, 26, 707-715 (cryst struct)