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
- 50606
- Core Entity Id
- 93617
- Source Entity Count
- 1
- Preferred Name
- cadinane-4β,5α,10β-triol
- Name En
- Pubchem Id
- 73110903
- Smiles Canonical
- CC(C)C1CCC(C)(O)C2CCC(C)(O)C(O)C12
- Molecular Formula
- C15H28O3
- Molecular Weight
- 256.2000
- Inchikey
- MOTZIEZYHAAEBY-UHFFFAOYSA-N
- Inchi
- InChI=1S/C15H28O3/c1-9(2)10-5-7-14(3,17)11-6-8-15(4,18)13(16)12(10)11/h9-13,16-18H,5-8H2,1-4H3
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 1.8000
- Num H Donors
- 3
- Num H Acceptors
- 3
- Num Rotatable Bonds
- 1
- Drug Likeness
- Polar Surface Area
- 60.7000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Cadinane-4β,5α,10β-triol
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
cadinane-4β,5α,10β-triol
Role
preferred
Source
TCMBank
Preferred
Yes
Name
台湾杉
Role
TCM_name
Source
TCMBank
Preferred
No
Name
TAI WAN SHAN
Role
TCM_name2
Source
TCMBank
Preferred
No
Name
Cryptomeria-like Taiwania
Role
TCM_name_en
Source
TCMBank
Preferred
No
Aliases
Additional names normalized into the restored final schema.
台湾杉TAI WAN SHANCryptomeria-like Taiwania
Cross References
Trusted external identifiers retained for this final record.
Tcmbank
TCMBANKIN035321TCMBANKIN059209
Etcm Ingredient
Cadinane-4β,5α,10β-triol
Itcmdb Generated
ITX-INGREDIENT-233AB739C4EAITX-INGREDIENT-47185BBFC097
Attributes
Merged source attributes and domain-specific metadata.
Smiles
CC(C)C1CCC(C2C1C(C(CC2)(C)O)O)(C)O
Tcm Name
台湾杉
Tcm Name2
TAI WAN SHAN
Mol2 Path
/TCM_database/2007_3d_all/02848.mol2
Reference
4371
Tcm Name En
Cryptomeria-like Taiwania
Molecular Weight
256.200
Molecular Formula
C15H28O3
Molecular Formula
C15H28O3
Fda Maximum Daily Dose (Fdamdd)
0.027
Quantitative Estimate Of Drug Likeness（Qed）
0.672