input word = C00045054

Metabolite InformationStructural formula
Name Salaquinone A
(+)-Salaquinone A
Formula C28H34O5
Mw 450.2406242
CAS RN 612836-45-0
C_ID C00045054 ,
InChIKey HLWNXIBAWDHKMJ-OOGCCUMDNA-N
InChICode InChI=1S/C28H34O5/c1-14-11-20-26(4,24(33)22(14)31)13-21(30)28(6)19-8-7-16-15(2)23(32)18(29)12-17(16)25(19,3)9-10-27(20,28)5/h7-8,12,14,20,24,32-33H,9-11,13H2,1-6H3/t14-,20-,24-,25+,26-,27+,28+/m1/s1
SMILES [C@@H]1(C(=O)[C@H]([C@]2([C@@H](C1)[C@]1([C@](C(=O)C2)(C2=CC=C3C(=CC(=O)C(=C3C)O)[C@@]2(CC1)C)C)C)C)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeSalacia chinensis Ref.
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