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Proanthocyanidin CF1
PHCD compound ID : 4003
Chemical Names :
Proanthocyanidin CF1
Molecular Formula : C30H26O9
Molecular Weight : 530.157682
More Details :
Names & Synonyms:
Smiles: Oc1ccc(cc1)[C@H]1Oc2c(c(O)cc(c2C[C@H]1O)O)[C@@H]1[C@@H](O)[C@H](Oc2c1ccc(c2)O)c1ccc(cc1)O
InChi : InChI=1S/C30H26O9/c31-16-5-1-14(2-6-16)28-23(36)12-20-21(34)13-22(35)26(30(20)39-28)25-19-10-9-18(33)11-24(19)38-29(27(25)37)15-3-7-17(32)8-4-15/h1-11,13,23,25,27-29,31-37H,12H2/t23-,25-,27-,28-,29-/m1/s1
InChi Key : InChIKey=MBDYBIJCLWLWDU-GKSSWXCNSA-N
PubChem ID :
Rotatable bond count : 3 Rule of five : 1
Hydrogen bond acceptor count : 9 Ionization potential : 8.786813
Hydrogen bond donor count : 7 Electric dipole moment : 3.879
XLogP : 0.512 VDW volume : 457.171781
Molecular weight : 530.157682 HOMO-LUMO gap : 8.607000
Herb list :
Refrences & Litretures:
  
547.      Journal:'J. Nat. Prod. Plant Resour'      Year:'2011'      Volume:'1'      Page:'101'      DOI:''      Title:'Cassia fistula Linn. (Amulthus)- An Important Medicinal Plant: A Review of Its Traditional Uses, Phytochemistry and Pharmacological Properties'
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