Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Links: 1
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 20478
- Core Entity Id
- 25943
- Source Entity Count
- 1
- Preferred Name
- Glycerol 2-o-alpha-l-fucopyranoside
- Name En
- Glycerol 2-O-α-L-fucopyranoside
- Pubchem Id
- 101159096
- Smiles Canonical
- CC1C(C(C(C(O1)OC(CO)CO)O)O)O
- Molecular Formula
- C9H18O7
- Molecular Weight
- 238.2360
- Inchikey
- ZVTDSJFUFCKPJJ-VDTAYCBBSA-N
- Inchi
- InChI=1S/C9H18O7/c1-4-6(12)7(13)8(14)9(15-4)16-5(2-10)3-11/h4-14H,2-3H2,1H3/t4-,6+,7+,8-,9-/m0/s1
- Isomeric Smiles
- C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)OC(CO)CO)O)O)O
- Cas Id
- Ob Score
- Mol Logp
- -2.8163
- Num H Donors
- 5
- Num H Acceptors
- 7
- Num Rotatable Bonds
- 4
- Drug Likeness
- 0.3580
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Glycerol 2-O--alpha-L-fucopyranoside
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
Glycerol 2-o-alpha-l-fucopyranoside
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Glycerol 2-o-alpha-l-fucopyranoside
Role
preferred
Source
itcmdb_public
Preferred
Yes
Aliases
Additional names normalized into the restored final schema.
Glycerol 2-O--alpha-L-fucopyranoside
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN028112
Npass
NPC252587
Tcmid
8809
Pub Chem
101159096
Etcm Ingredient
Glycerol 2-O--alpha-L-fucopyranoside
Itcmdb Generated
ITX-INGREDIENT-E914181BE70B
Attributes
Merged source attributes and domain-specific metadata.
In Ch I
InChI=1S/C9H18O7/c1-4-6(12)7(13)8(14)9(15-4)16-5(2-10)3-11/h4-14H,2-3H2,1H3/t4-,6+,7+,8-,9-/m0/s1
Mol Wt
238.236
Mol Log P
-2.816299999999998
In Ch Ikey
ZVTDSJFUFCKPJJ-VDTAYCBBSA-N
Num Hdonors
5
Drug Likeness
0.358
Num Hacceptors
7
Isomeric Smiles
C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)OC(CO)CO)O)O)O
Canonical Smiles
CC1C(C(C(C(O1)OC(CO)CO)O)O)O
Molecular Weight
238.110
Molecular Formula
C9H18O7
Molecular Formula
C9H18O7
Num Rotatable Bonds
4
Fda Maximum Daily Dose (Fdamdd)
0.001
Quantitative Estimate Of Drug Likeness（Qed）
0.358