input word = C00058899

Metabolite InformationStructural formula
Name Sodium (E)-7-hydroxy-1,7-bis(4-hydroxyphenyl)-hept-5-ene-3R-sulfonate
Formula C19H22O6S1-
Mw 378.11370917
CAS RN 1008165-48-7
C_ID C00058899
InChIKey QGCLNWMFTGVIKH-IPANSWIVSA-N
InChICode InChI=1S/C19H22O6S.Na/c20-16-9-4-14(5-10-16)6-13-18(26(23,24)25)2-1-3-19(22)15-7-11-17(21)12-8-15;/h1,3-5,7-12,18-22H,2,6,13H2,(H,23,24,25);/b3-1+;/t18-,19?;/m0./s1
SMILES O=S(=O)(O)C(CC=CC(O)c1ccc(O)cc1)CCc1ccc(O)cc1.[Na]
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeZingiberaceaeZingiber officinale Ref.
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