input word = C00015815

Metabolite InformationStructural formula
Name Marchantin H
Formula C28H24O5
Mw 440.16237388
CAS RN 99481-36-4
C_ID C00015815 ,
InChIKey BVVNNKLMNVFVGS-UHFFFAOYSA-N
InChICode InChI=1S/C28H24O5/c29-24-14-9-20-5-4-19-2-1-3-23(16-19)33-28-21(11-15-25(30)27(28)31)10-6-18-7-12-22(13-8-18)32-26(24)17-20/h1-3,7-9,11-17,29-31H,4-6,10H2
SMILES c1cc2ccc1Oc1cc(ccc1O)CCc1cc(ccc1)Oc1c(CC2)ccc(c1O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAytoniaceaeAsterella angusta Ref.
PlantaeAytoniaceaePlagiochasma intermedium Ref.
PlantaeMarchantiaceaeMarchantia diptera Ref.
PlantaeMarchantiaceaeMarchantia polymorpha Ref.
PlantaePlagiochilaceaePlagiochila sciophila Ref.
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OrganismPlagiochasma intermedium
ReferenceTori,Application of 2D NMR techniques to structure determination of natural products, in Natural Products Chemistry,Elsevier,(1988),81