Primary Record
Pavetannin B-3
- In stock
- 550 g
- Purity
- 98.1 %
Compound Identifiers & Properties
- PubChem CID
- 177548224
- SMILES
- C1[C@H]([C@H](OC2=C1C(=CC(=C2[C@H]3[C@H]([C@H](OC4=CC5=C([C@H]6[C@H]([C@@](O5)(OC7=CC(=CC(=C67)O)O)C8=CC(=C(C=C8)O)O)O)C(=C34)O)C9=CC(=C(C=C9)O)O)O)O)O)C1=CC(=C(C=C1)O)O)O
- Canonical SMILES
- Oc1cc(O)c2c(c1)O[C@]1(c3ccc(O)c(O)c3)Oc3cc4c(c(O)c3[C@H]2[C@H]1O)[C@@H](c1c(O)cc(O)c2c1O[C@H](c1ccc(O)c(O)c1)[C@H](O)C2)[C@@H](O)[C@@H](c1ccc(O)c(O)c1)O4
Names & Synonyms
- Pavetannin B-3
- J454.253C
- (1S,5S,6R,7R,13R,21R)-7,13-bis(3,4-dihydroxyphenyl)-5-[(2R,3R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-8-yl]-8,12,14-trioxapentacyclo[11.7.1.02,11.04,9.015,20]henicosa-2(11),3,9,15,17,19-hexaene-3,6,17,19,21-pentol
- (6R,15R)-6,10alpha-Bis(3,4-dihydroxyphenyl)-12beta-[[(2R)-2alpha-(3,4-dihydroxyphenyl)-3,4-dihydro-3alpha,5,7-trihydroxy-2H-1-benzopyran]-8-yl]-11,12-dihydro-6beta,14beta-methano-10H,14H-[1]benzopyrano[7,6-d][1,3]benzodioxocin-1,3,11alpha,13,15-pentol