input word = C00038030

Metabolite InformationStructural formula
Name Yunnaneic acid D
Formula C27H24O12
Mw 540.12677623
CAS RN 180314-57-2
C_ID C00038030 ,
InChIKey WSNGPQNYHJVZGN-NHRYKAGUNA-N
InChICode InChI=1S/C27H24O12/c28-15-4-1-11(7-17(15)30)8-19(26(35)36)39-20(32)6-3-12-9-14-21(13-2-5-16(29)18(31)10-13)23(27(37)38)22(12)25(34)24(14)33/h1-7,9-10,14,19,21-24,28-31,33H,8H2,(H,35,36)(H,37,38)/b6-3+/t14-,19-,21+,22+,23-,24-/m1/s1
SMILES O=C(/C=C/C1=C[C@@H]2[C@H](c3ccc(O)c(O)c3)[C@@H](C(=O)O)[C@H]1C(=O)[C@@H]2O)O[C@H](Cc1ccc(O)c(O)c1)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeSalvia yunnanensis Ref.
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