input word = C00006528

Metabolite InformationStructural formula
Name Hypnogenol B1
Formula C30H20O12
Mw 572.09547611
CAS RN 156250-61-2
C_ID C00006528 ,
InChIKey GDBFJHVSMVHPPW-UHFFFAOYNA-N
InChICode InChI=1S/C30H20O12/c31-13-7-19(35)23-21(9-13)41-29(27(39)25(23)37)11-1-3-17(33)15(5-11)16-6-12(2-4-18(16)34)30-28(40)26(38)24-20(36)8-14(32)10-22(24)42-30/h1-10,27,29,31-36,39-40H/t27-,29-/m0/s1
SMILES c1c(c(ccc1[C@@H]1Oc2c(C(=O)[C@@H]1O)c(cc(c2)O)O)O)c1c(ccc(c1)c1oc2c(c(=O)c1O)c(cc(c2)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHypnaceaeHypnum cupressiforme Ref.
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