IngredientID 2439
2-phenylethyl-6-o-alpha-l-arabinofuranosyl-beta-d-glucopyranoside
C19H28O10
Relationship Network
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Herb: 1Ingredient: 1Links: 1
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Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 2439
- Core Entity Id
- 5898
- Source Entity Count
- 1
- Preferred Name
- 2-phenylethyl-6-o-alpha-l-arabinofuranosyl-beta-d-glucopyranoside
- Name En
- Pubchem Id
- 14682811
- Smiles Canonical
- C1=CC=C(C=C1)CCOC2C(C(C(C(O2)COC3C(C(C(O3)CO)O)O)O)O)O
- Molecular Formula
- C19H28O10
- Molecular Weight
- 416.4000
- Inchikey
- DWYFWLYCTOAXKY-DXAFFUQDSA-N
- Inchi
- InChI=1S/C19H28O10/c20-8-11-13(21)16(24)19(28-11)27-9-12-14(22)15(23)17(25)18(29-12)26-7-6-10-4-2-1-3-5-10/h1-5,11-25H,6-9H2/t11-,12+,13-,14+,15-,16+,17+,18+,19+/m0/s1
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- -1.6000
- Num H Donors
- 6
- Num H Acceptors
- 10
- Num Rotatable Bonds
- 8
- Drug Likeness
- Polar Surface Area
- 158.0000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
2-phenylethyl-6-o-alpha-l-arabinofuranosyl-beta-d-glucopyranoside
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
2-phenylethyl-6-o-alpha-l-arabinofuranosyl-beta-d-glucopyranoside
Role
preferred
Source
itcmdb_public
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN006313
Tcmid
34769