Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Target: 4Links: 9
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 51813
- Core Entity Id
- 94824
- Source Entity Count
- 1
- Preferred Name
- 10-(β-hydroxybutyryl)-10-deacetyltaxol
- Name En
- Pubchem Id
- Smiles Canonical
- Molecular Formula
- C49H55NO15
- Molecular Weight
- 897.3600
- 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
10-(β-Hydroxybutyryl)-10-deacetyltaxol
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
10-(β-hydroxybutyryl)-10-deacetyltaxol
Role
preferred
Source
TCMBank
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Tcmbank
TCMBANKIN041513
Etcm Ingredient
10-(β-Hydroxybutyryl)-10-deacetyltaxol
Itcmdb Generated
ITX-INGREDIENT-74E57C01CAC5
Attributes
Merged source attributes and domain-specific metadata.
Mol2 Path
/TCM_database/2007_3d_all/09867.mol2
Reference
662
Molecular Weight
897.360
Molecular Formula
C49H55NO15
Molecular Formula
C49H55NO15
Fda Maximum Daily Dose (Fdamdd)
0.930
Quantitative Estimate Of Drug Likeness（Qed）
0.129