salvianolate Report issue

Small molecule Experimental
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Chemistry

Mol. Mass

494.45

ALogP

3.34

Rule of 5

No

Rule of 3

No
Details
  • SMILES: O=C(/C=C/c1ccc(O)c(O)c1/C=C/c1ccc(O)c(O)c1)O[C@H](Cc1ccc(O)c(O)c1)C(=O)O
  • InChIKey: YMGFTDKNIWPMGF-UCPJVGPRSA-N
    InChI=1S/C26H22O10/c27-18-7-2-14(11-21(18)30)1-6-17-16(4-9-20(29)25(17)33)5-10-24(32)36-23(26(34)35)13-15-3-8-19(28)22(31)12-15/h1-12,23,27-31,33H,13H2,(H,34,35)/b6-1+,10-5+/t23-/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL457077   ChEMBL
salvianolic acid a

Salvia miltiorrhiza   Wikipedia

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