Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
Click a node to open it in a new tab
Herb: 1Ingredient: 1Target: 7Links: 15
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 18288
- Core Entity Id
- 23505
- Source Entity Count
- 1
- Preferred Name
- Epipachysamine aii
- Name En
- Pubchem Id
- Smiles Canonical
- C=C(C)N(C)[C@@H](C)[C@H]1CC[C@@H]2[C@@H]3CC[C@H]4C[C@H](N(C)C)CC[C@]4(C)[C@H]3CC[C@@]21C.O
- Molecular Formula
- C26H46N2O
- Molecular Weight
- 400.3800
- Inchikey
- Inchi
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 5.6047
- Num H Donors
- 0
- Num H Acceptors
- 2
- Num Rotatable Bonds
- 4
- Drug Likeness
- Polar Surface Area
- 37.9800
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Epipachysamine A(II)
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
Epipachysamine a(ii)
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
Epipachysamine aii
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
epipachysamine aii
Role
preferred
Source
TCMBank
Preferred
Yes
Name
雪山林
Role
TCM_name
Source
TCMBank
Preferred
No
Name
XUE SHAN LIN
Role
TCM_name2
Source
TCMBank
Preferred
No
Name
Japanese Pachysandra
Role
TCM_name_en
Source
TCMBank
Preferred
No
Aliases
Additional names normalized into the restored final schema.
Epipachysamine A(II)雪山林XUE SHAN LINJapanese Pachysandra
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN025396HBIN025397
Tcmid
304656989
Tcmbank
TCMBANKIN037752TCMBANKIN038805
Etcm Ingredient
Epipachysamine A(II)Epipachysamine AII
Itcmdb Generated
ITX-INGREDIENT-36098693E594ITX-INGREDIENT-5119F190A897
Attributes
Merged source attributes and domain-specific metadata.
Smiles
C1([H])([H])C([H])([H])[C@](C([H])([H])[H])([C@@]([H])(C([H])([H])C([H])([H])[C@@]([C@@]([H])([C@@]([H])(N(C(C([H])([H])[H])=C([H])[H])C([H])([H])[H])C([H])([H])[H])C([H])([H])C2([H])[H])(C([H])([H])[
H])[C@]23[H])[C@@]3([H])C([H])([H])C4([H])[H])[C@]4([H])C([H])([H])[C@]1([H])N(C([H])([H])[H])C([H])([H])[H].O
Tcm Name
雪山林
Tcm Name2
XUE SHAN LIN
Mol2 Path
/TCM_database/2003_3d_all/2770.mol2/TCM_database/2007_3d_all/06990.mol2
Reference
941, 114, 111, 971, 200941, 1141, 1197, 1200
Tcm Name En
Japanese Pachysandra
Molecular Weight
400.380402.360
Molecular Formula
C26H46N2OC27H48N2
Molecular Formula
C26H46N2OC27H50N2O
Molecular Formula
C26H46N2OC27H50N2O
Fda Maximum Daily Dose (Fdamdd)
0.3440.772
Quantitative Estimate Of Drug Likeness（Qed）
0.5360.627