Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 7Ingredient: 1Target: 8Links: 15
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 37010
- Core Entity Id
- 44338
- Source Entity Count
- 1
- Preferred Name
- Yomogi alcohol
- Name En
- Pubchem Id
- 5315406
- Smiles Canonical
- CC(C)(C=C)C=CC(C)(C)O
- Molecular Formula
- C10H18O
- Molecular Weight
- 154.2530
- Inchikey
- CSMMFGCGBLZIJE-BQYQJAHWSA-N
- Inchi
- InChI=1S/C10H18O/c1-6-9(2,3)7-8-10(4,5)11/h6-8,11H,1H2,2-5H3/b8-7+
- Isomeric Smiles
- CC(C)(C=C)/C=C/C(C)(C)O
- Cas Id
- 26127-98-0
- Ob Score
- 41.5870
- Mol Logp
- 2.5257
- Num H Donors
- 1
- Num H Acceptors
- 1
- Num Rotatable Bonds
- 3
- Drug Likeness
- 0.6190
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Yomogi Alcohol
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
Yomogi alcohol
Role
preferred
Source
TCMBank
Preferred
Yes
Name
Yomogi alcohol
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
Yomogi alcohol
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
Yomogi alcohol
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
(3E)-2,5,5-trimethylhepta-3,6-dien-2-ol
Role
alias
Source
TCMBank
Preferred
No
Name
(E)-2,5,5-Trimethylhepta-3,6-dien-2-ol
Role
alias
Source
TCMBank
Preferred
No
Name
(E)-2,5,5-Trimethylhepta-3,6-dien-2-ol
Role
alias
Source
HERB_v2
Preferred
No
Name
(E)-2,5,5-Trimethylhepta-3,6-dien-2-ol
Role
alias
Source
itcmdb_public
Preferred
No
Name
2,5,5-trimethyl-3,6-heptadien-2-ol
Role
alias
Source
itcmdb_public
Preferred
No
Name
2,5,5-trimethyl-3,6-heptadien-2-ol
Role
alias
Source
HERB_v2
Preferred
No
Name
26127-98-0
Role
alias
Source
HERB_v2
Preferred
No
Name
26127-98-0
Role
alias
Source
TCMBank
Preferred
No
Name
26127-98-0
Role
alias
Source
itcmdb_public
Preferred
No
Name
3,3,6-Trimethyl-1,4-heptadien-6-ol
Role
alias
Source
itcmdb_public
Preferred
No
Name
3,3,6-Trimethyl-1,4-heptadien-6-ol
Role
alias
Source
HERB_v2
Preferred
No
Name
3,3,6-Trimethyl-1,4-heptadien-6-ol
Role
alias
Source
TCMBank
Preferred
No
Name
EINECS 247-474-7
Role
alias
Source
itcmdb_public
Preferred
No
Name
EINECS 247-474-7
Role
alias
Source
TCMBank
Preferred
No
Name
EINECS 247-474-7
Role
alias
Source
HERB_v2
Preferred
No
Name
WQW4TYB2RH
Role
alias
Source
HERB_v2
Preferred
No
Name
WQW4TYB2RH
Role
alias
Source
itcmdb_public
Preferred
No
Name
Yogomi alcohol
Role
alias
Source
itcmdb_public
Preferred
No
Name
Yogomi alcohol
Role
alias
Source
HERB_v2
Preferred
No
Name
Yomogi alcohol A
Role
alias
Source
itcmdb_public
Preferred
No
Name
Yomogi alcohol A
Role
alias
Source
HERB_v2
Preferred
No
Name
Yomogi alcohol A
Role
alias
Source
TCMBank
Preferred
No
Name
yomogialkohol
Role
alias
Source
HERB_v2
Preferred
No
Name
yomogialkohol
Role
alias
Source
itcmdb_public
Preferred
No
Aliases
Additional names normalized into the restored final schema.
(3E)-2,5,5-trimethylhepta-3,6-dien-2-ol(E)-2,5,5-Trimethylhepta-3,6-dien-2-ol2,5,5-trimethyl-3,6-heptadien-2-ol26127-98-03,3,6-Trimethyl-1,4-heptadien-6-olEINECS 247-474-7WQW4TYB2RHYogomi alcoholYomogi alcohol Ayomogialkohol
Cross References
Trusted external identifiers retained for this final record.
Cas
26127-98-0
Herb
HBIN048647HBIN048648
Npass
NPC10585
Tcmid
22906
Tcmsp
MOL005620
Sym Map
SMIT07349SMIT18267
Tcm Id
24305
Pub Chem
5315406
Tcmbank
TCMBANKIN029481TCMBANKIN059092
Etcm Ingredient
Yomogi alcohol
Itcmdb Generated
ITX-INGREDIENT-12BE0CA8814C
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
In Ch I
InChI=1S/C10H18O/c1-6-9(2,3)7-8-10(4,5)11/h6-8,11H,1H2,2-5H3/b8-7+
Mol Wt
154.253
Cas Id
26127-98-0
Smiles
CC(C)(C=C)C=CC(C)(C)O
Mol Log P
2.525700000000001
Version
v1,v2
In Ch Ikey
CSMMFGCGBLZIJE-BQYQJAHWSA-N
Ob Score
41.58741.5872305541.587231
Suppress
0
Num Hdonors
1
Drug Likeness
0.619
Num Hacceptors
1
Isomeric Smiles
CC(C)(C=C)/C=C/C(C)(C)O
Molecule Weight
154.28
Canonical Smiles
CC(C)(C=C)C=CC(C)(C)O
Herb Alias Names
26127-98-0(E)-2,5,5-Trimethylhepta-3,6-dien-2-ol3,3,6-Trimethyl-1,4-heptadien-6-olYomogi alcohol A2,5,5-trimethyl-3,6-heptadien-2-olyomogialkoholYogomi alcoholEINECS 247-474-7WQW4TYB2RH
Molecular Weight
154.140
Molecular Weight
154.25
Molecular Formula
C10H18O
Molecular Formula
C10H18O
Molecular Formula
C10H18O
Num Rotatable Bonds
3
Fda Maximum Daily Dose (Fdamdd)
0.034
Quantitative Estimate Of Drug Likeness（Qed）
0.619