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
- 13093
- Core Entity Id
- 17723
- Source Entity Count
- 1
- Preferred Name
- Bryophyllol
- Name En
- Pubchem Id
- Smiles Canonical
- Molecular Formula
- C29H50O4
- Molecular Weight
- 484.4300
- Inchikey
- Inchi
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- Num H Donors
- Num H Acceptors
- Num Rotatable Bonds
- Drug Likeness
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Bryophyllol
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
Bryophyllol
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Bryophyllol
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
bryophyllol
Role
preferred
Source
TCMBank
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN018941
Tcmid
2691
Tcmbank
TCMBANKIN038887
Etcm Ingredient
Bryophyllol
Itcmdb Generated
ITX-INGREDIENT-05D2EF3A72B9
Attributes
Merged source attributes and domain-specific metadata.
Mol2 Path
/TCM_database/2007_3d_all/02691.mol2
Reference
660
Molecular Weight
484.430
Molecular Formula
C33H56O2
Molecular Formula
C29H50O4
Molecular Formula
C29H50O4
Fda Maximum Daily Dose (Fdamdd)
0.393
Quantitative Estimate Of Drug Likeness（Qed）
0.288