input word = C00052299

Metabolite InformationStructural formula
Name Gravacridonolchlorine
Formula C19H18ClNO5
Mw 375.0873504
CAS RN 38494-85-8
C_ID C00052299
InChIKey OYGSTYGNRLPAMK-UHFFFAOYSA-N
InChICode InChI=1S/C19H18ClNO5/c1-21-12-5-3-2-4-10(12)18(25)16-13(24)7-14-11(17(16)21)6-15(26-14)19(20,8-22)9-23/h2-5,7,15,22-24H,6,8-9H2,1H3
SMILES Cn1c2ccccc2c(=O)c2c(O)cc3c(c21)CC(C(Cl)(CO)CO)O3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeRuta graveolens Ref.
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