(6αS,11αS)-4-dimethylallyl-3,6α,9-trihydroxypterocarpan

(6α<i>S</i>,11α<i>S</i>)-4-dimethylallyl-3,6α,9-trihydroxypterocarpan




Chemical Formula:
C20H20O5
Molecular Weight:
340.375 Daltons
Monoisotopic Mass:
340.13107375249996 Daltons
SMILES:
CC(C)=CCC4(C3(=C([CH]2(OC1(C(=CC=C(O)C=1)C(O)2CO3)))C=CC(O)=4))
InChI:
1S/C20H20O5/c1-11(2)3-5-13-16(22)8-6-14-18(13)24-10-20(23)15-7-4-12(21)9-17(15)25-19(14)20/h3-4,6-9,19,21-23H,5,10H2,1-2H3/t19-,20+/m0/s1
InChIKey:
NLHMQOCIFRDSNU-VQTJNVASSA-N

Synonyms
  • 4-Dimethylallylglycinol
  • (+)-4-dimethylallyl-3,6α,9-trihydroxypterocarpan
  • 2-(6αS,11αS)-dimethylallyl-3,6α,9-trihydroxypterocarpan

Databases
MetaCyc:  CPD-4403
ChemSpider:  10128487
PubChem (CID):  11954192
ChEBI:  50036
KEGG:  C15510
Seed:  cpd11190
MetaNetX:  MNXM2162