Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 6Ingredient: 1Target: 1Links: 8
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 20761
- Core Entity Id
- 26258
- Source Entity Count
- 1
- Preferred Name
- (?)-guaia-1(10),11-dien-15-ol
- Name En
- Pubchem Id
- 101615177
- Smiles Canonical
- CC1CCC2=C(CCC(CC12)C(=C)C)CO
- Molecular Formula
- C15H24O
- Molecular Weight
- 220.3560
- Inchikey
- XDJJQGUABGVLLV-ZOWXZIJZSA-N
- Inchi
- InChI=1S/C15H24O/c1-10(2)12-5-6-13(9-16)14-7-4-11(3)15(14)8-12/h11-12,15-16H,1,4-9H2,2-3H3/t11-,12+,15-/m0/s1
- Isomeric Smiles
- C[C@H]1CCC2=C(CC[C@H](C[C@@H]12)C(=C)C)CO
- Cas Id
- Ob Score
- Mol Logp
- 3.6976
- Num H Donors
- 1
- Num H Acceptors
- 1
- Num Rotatable Bonds
- 2
- Drug Likeness
- 0.7040
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
(-)-Guaia-1(10),11-dien-15-ol
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
(?)-guaia-1(10),11-dien-15-ol
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
(?)-guaia-1(10),11-dien-15-ol
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
(−)-Guaia-1(10),11-Dien-15-Ol
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
(−)-Guaia-1(10),11-dien-15-ol
Role
preferred
Source
TCMBank
Preferred
Yes
Name
沉香
Role
TCM_name
Source
TCMBank
Preferred
No
Name
CHEN XIANG
Role
TCM_name2
Source
TCMBank
Preferred
No
Name
Eaglewood
Role
TCM_name_en
Source
TCMBank
Preferred
No
Aliases
Additional names normalized into the restored final schema.
(-)-Guaia-1(10),11-dien-15-ol(−)-Guaia-1(10),11-Dien-15-Ol沉香CHEN XIANGEaglewood
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN028452
Npass
NPC102162
Tcmid
256269031
Sym Map
SMIT15687SMIT18918
Pub Chem
101615177
Tcmbank
TCMBANKIN043823
Etcm Ingredient
(-)-Guaia-1(10),11-dien-15-ol
Itcmdb Generated
ITX-INGREDIENT-344FBA5685D6ITX-INGREDIENT-C8537203B6C2
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
In Ch I
InChI=1S/C15H24O/c1-10(2)12-5-6-13(9-16)14-7-4-11(3)15(14)8-12/h11-12,15-16H,1,4-9H2,2-3H3/t11-,12+,15-/m0/s1
Mol Wt
220.356
Mol Log P
3.697600000000003
Version
v1
In Ch Ikey
XDJJQGUABGVLLV-ZOWXZIJZSA-N
Suppress
0
Tcm Name
沉香
Tcm Name2
CHEN XIANG
Mol2 Path
/TCM_database/2007_3d_all/09032.mol2
Reference
13, 2551
Num Hdonors
1
Tcm Name En
Eaglewood
Drug Likeness
0.704
Num Hacceptors
1
Isomeric Smiles
C[C@H]1CCC2=C(CC[C@H](C[C@@H]12)C(=C)C)CO
Canonical Smiles
CC1CCC2=C(CCC(CC12)C(=C)C)CO
Molecular Weight
220.180
Molecule Formula
C15H24O
Molecular Formula
C15H24O
Molecular Formula
C15H24O
Num Rotatable Bonds
2
Fda Maximum Daily Dose (Fdamdd)
0.502
Quantitative Estimate Of Drug Likeness（Qed）
0.704