input word = C00006200

Metabolite InformationStructural formula
Name Flavocannabiside
Formula C27H30O16
Mw 610.15338491
CAS RN 64661-76-3
C_ID C00006200 ,
InChIKey QQBFHNKJGBCSLG-XZPZFLLANA-N
InChICode InChI=1S/C27H30O16/c28-6-15-20(36)22(38)26(43-27-23(39)21(37)19(35)16(7-29)42-27)25(41-15)18-12(33)4-11(32)17-13(34)5-14(40-24(17)18)8-1-2-9(30)10(31)3-8/h1-5,15-16,19-23,25-33,35-39H,6-7H2/t15-,16-,19-,20-,21+,22+,23+,25+,26-,27+/m1/s1
SMILES c1(cc(c2c(c1[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)oc(cc2=O)c1cc(c(cc1)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCannabaceaeCannabis sativa Ref.
PlantaeMolluginaceaeMollugo cerviana Ref.
PlantaePoaceaeSetaria italica Ref.
PlantaePodocarpaceaePodocarpus totara Ref.
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