Procyanidin dimer B7
precursor
Showing entry for Procyanidin dimer B7
Identification
- PhytoHub ID
- PHUB000281
- Name
- Procyanidin dimer B7
- Systematic Name
- Not Available
- Synonyms
- Epicatechin-(4,6)-catechin
- CAS Number
- Not Available
- Average Mass
- 578.526
- Monoisotopic Mass
- 578.142426277
- Chemical Formula
- C30H26O12
- IUPAC Name
- Not Available
- InChI Key
- OHIUVDQGXUITJQ-RRZQRCDDSA-N
- InChI Identifier
InChI=1S/C30H26O12/c31-13-7-20(36)23-22(8-13)42-30(12-2-4-17(33)19(35)6-12)28(40)25(23)24-21(37)9-14-15(26(24)38)10-41-29(27(14)39)11-1-3-16(32)18(34)5-11/h1-9,25,27-40H,10H2/t25-,27+,28?,29-,30-/m1/s1
- SMILES
OC1[[email protected]](OC2=CC(O)=CC(O)=C2[[email protected]@H]1C1=C(O)C2=C(C=C1O)[[email protected]](O)[[email protected]](OC2)C1=CC=C(O)C(O)=C1)C1=CC(O)=C(O)C=C1
- Structure
Structure for Procyanidin dimer B7
Calculated Properties
- Solubility (ALOGPS)
- 1.40e-01 g/l
- LogS (ALOGPS)
- -3.62
- LogP (ALOGPS)
- 2.22
- Hydrogen Acceptors
- Not Available
- Hydrogen Donors
- Not Available
- Rotatable Bond Count
- Not Available
- Polar Surface Area
- Not Available
- Refractivity
- Not Available
- Polarizability
- Not Available
- Formal Charge
- Not Available
- Physiological Charge
- Not Available
- pKa (strongest basic)
- Not Available
- pKa (strongest acidic)
- Not Available
- Number of Rings
- Not Available
- Rule of Five
- No
- Bioavailability
- No
- Ghose Filter
- No
- Veber's Rule
- No
- MDDR-like Rule
- No
External Links
- PubChem
- 13990893
Taxonomy as Precursor
- Family
- Polyphenols
- Class
- Flavonoids
- Sub-class
- Flavanols
Spectra
No spectra information available
Food Sources
| Name | Group | |||
|---|---|---|---|---|
| Apple | Fruit, Pomes | Publications | Show | |
| Green tea | Teas and herbal teas | Publications | Show |
Metabolism
No metabolism information available
Inter-Individual Variations Metabolism
No inter-individual variations available