input word = C00052075

Metabolite InformationStructural formula
Name Acrimarine I
Formula C34H31NO7
Mw 565.21005235
CAS RN 147395-89-9
C_ID C00052075
InChIKey GSUYTELQWICLMF-UHFFFAOYSA-N
InChICode InChI=1S/C34H31NO7/c1-17(2)14-22(21-15-18-10-11-26(37)41-24(18)16-25(21)40-6)27-32(39)28-30(20-12-13-34(3,4)42-33(20)27)35(5)29-19(31(28)38)8-7-9-23(29)36/h7-16,22,36,39H,1-6H3
SMILES COc1cc2oc(=O)ccc2cc1C(C=C(C)C)c1c2c(c3c(c1O)c(=O)c1cccc(O)c1n3C)C=CC(C)(C)O2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeCitrus hybrids Ref.
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