Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 9Ingredient: 1Target: 12Links: 21
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 17211
- Core Entity Id
- 22300
- Source Entity Count
- 1
- Preferred Name
- Dihydroresveratrol
- Name En
- Pubchem Id
- 185914
- Smiles Canonical
- C1=CC(=CC=C1CCC2=CC(=CC(=C2)O)O)O
- Molecular Formula
- C14H14O3
- Molecular Weight
- 230.2630
- Inchikey
- HITJFUSPLYBJPE-UHFFFAOYSA-N
- Inchi
- InChI=1S/C14H14O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h3-9,15-17H,1-2H2
- Isomeric Smiles
- C1=CC(=CC=C1CCC2=CC(=CC(=C2)O)O)O
- Cas Id
- 58436-28-5
- Ob Score
- 87.2730
- Mol Logp
- 2.5886
- Num H Donors
- 3
- Num H Acceptors
- 3
- Num Rotatable Bonds
- 3
- Drug Likeness
- 0.7590
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Dihydroresveratrol
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
Dihydroresveratrol
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
Dihydroresveratrol
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Dihydroresveratrol
Role
preferred
Source
TCMBank
Preferred
Yes
Name
1,3-Benzenediol, 5-(2-(4-hydroxyphenyl)ethyl)-
Role
alias
Source
TCMBank
Preferred
No
Name
151363-17-6
Role
alias
Source
TCMBank
Preferred
No
Name
3,4'',5-trihydroxybibenzyl
Role
alias
Source
TCMBank
Preferred
No
Name
3,4',5-Trihydroxybibenzyl
Role
alias
Source
HERB_v2
Preferred
No
Name
3,4',5-Trihydroxybibenzyl
Role
alias
Source
itcmdb_public
Preferred
No
Name
3,5,4'-trihydroxybibenzyl
Role
alias
Source
TCMBank
Preferred
No
Name
3ftu
Role
alias
Source
TCMBank
Preferred
No
Name
4CN-1275
Role
alias
Source
TCMBank
Preferred
No
Name
5-(4-hydroxyphenethyl)benzene-1,3-diol
Role
alias
Source
itcmdb_public
Preferred
No
Name
5-(4-hydroxyphenethyl)benzene-1,3-diol
Role
alias
Source
HERB_v2
Preferred
No
Name
5-(4-hydroxyphenethyl)benzene-1,3-diol
Role
alias
Source
TCMBank
Preferred
No
Name
5-[2-(4-Hydroxy-phenyl)-ethyl]-benzene-1,3-diol
Role
alias
Source
TCMBank
Preferred
No
Name
5-[2-(4-hydroxyphenyl)ethyl]-1,3-Benzenediol
Role
alias
Source
TCMBank
Preferred
No
Name
5-[2-(4-hydroxyphenyl)ethyl]benzene-1,3-diol
Role
alias
Source
itcmdb_public
Preferred
No
Name
5-[2-(4-hydroxyphenyl)ethyl]benzene-1,3-diol
Role
alias
Source
HERB_v2
Preferred
No
Name
5-[2-(4-hydroxyphenyl)ethyl]resorcinol
Role
alias
Source
TCMBank
Preferred
No
Name
58436-28-5
Role
alias
Source
HERB_v2
Preferred
No
Name
58436-28-5
Role
alias
Source
itcmdb_public
Preferred
No
Name
58436-28-5
Role
alias
Source
TCMBank
Preferred
No
Name
AC1L4HRG
Role
alias
Source
TCMBank
Preferred
No
Name
AC1Q79W7
Role
alias
Source
TCMBank
Preferred
No
Name
AK586206
Role
alias
Source
TCMBank
Preferred
No
Name
AKOS030555676
Role
alias
Source
TCMBank
Preferred
No
Name
BDBM50085531
Role
alias
Source
TCMBank
Preferred
No
Name
C10255
Role
alias
Source
TCMBank
Preferred
No
Name
CBY43AY0TT
Role
alias
Source
itcmdb_public
Preferred
No
Name
CBY43AY0TT
Role
alias
Source
HERB_v2
Preferred
No
Name
CHEBI:4582
Role
alias
Source
itcmdb_public
Preferred
No
Name
CHEBI:4582
Role
alias
Source
HERB_v2
Preferred
No
Name
CHEBI:4582
Role
alias
Source
TCMBank
Preferred
No
Name
CHEMBL111234
Role
alias
Source
TCMBank
Preferred
No
Name
CTK5A8302
Role
alias
Source
TCMBank
Preferred
No
Name
D00TWK
Role
alias
Source
TCMBank
Preferred
No
Name
DB08466
Role
alias
Source
TCMBank
Preferred
No
Name
Dihydro-Resveratrol
Role
alias
Source
HERB_v2
Preferred
No
Name
Dihydro-Resveratrol
Role
alias
Source
itcmdb_public
Preferred
No
Name
Dihydroresveratol
Role
alias
Source
TCMBank
Preferred
No
Name
FT-0756540
Role
alias
Source
TCMBank
Preferred
No
Name
LMPK13090035
Role
alias
Source
TCMBank
Preferred
No
Name
MFCD25973128
Role
alias
Source
HERB_v2
Preferred
No
Name
MFCD25973128
Role
alias
Source
itcmdb_public
Preferred
No
Name
MolPort-035-706-156
Role
alias
Source
TCMBank
Preferred
No
Name
NSC723534
Role
alias
Source
TCMBank
Preferred
No
Name
RE2
Role
alias
Source
TCMBank
Preferred
No
Name
SCHEMBL716856
Role
alias
Source
TCMBank
Preferred
No
Name
UNII-CBY43AY0TT
Role
alias
Source
HERB_v2
Preferred
No
Name
UNII-CBY43AY0TT
Role
alias
Source
itcmdb_public
Preferred
No
Name
W2088
Role
alias
Source
TCMBank
Preferred
No
Name
ZINC899123
Role
alias
Source
TCMBank
Preferred
No
Name
a, b-Dihydroresveratrol
Role
alias
Source
TCMBank
Preferred
No
Name
alpha,beta-dihydro-3,40,5-trihydroxystilbene
Role
alias
Source
TCMBank
Preferred
No
Name
dihydroresveratrol
Role
alias
Source
TCMBank
Preferred
No
Aliases
Additional names normalized into the restored final schema.
1,3-Benzenediol, 5-(2-(4-hydroxyphenyl)ethyl)-151363-17-63,4'',5-trihydroxybibenzyl3,4',5-Trihydroxybibenzyl3,5,4'-trihydroxybibenzyl3ftu4CN-12755-(4-hydroxyphenethyl)benzene-1,3-diol5-[2-(4-Hydroxy-phenyl)-ethyl]-benzene-1,3-diol5-[2-(4-hydroxyphenyl)ethyl]-1,3-Benzenediol5-[2-(4-hydroxyphenyl)ethyl]benzene-1,3-diol5-[2-(4-hydroxyphenyl)ethyl]resorcinol58436-28-5AC1L4HRGAC1Q79W7AK586206AKOS030555676BDBM50085531C10255CBY43AY0TTCHEBI:4582CHEMBL111234CTK5A8302D00TWKDB08466Dihydro-ResveratrolDihydroresveratolFT-0756540LMPK13090035MFCD25973128MolPort-035-706-156NSC723534RE2SCHEMBL716856UNII-CBY43AY0TTW2088ZINC899123a, b-Dihydroresveratrolalpha,beta-dihydro-3,40,5-trihydroxystilbene
Cross References
Trusted external identifiers retained for this final record.
Cas
58436-28-5
Herb
HBIN023972
Npass
NPC30506
Tcmid
5699
Tcmsp
MOL009782
Sym Map
SMIT10866SMIT15087
Tcm Id
4867
Pub Chem
185914
Tcmbank
TCMBANKIN044178
Attributes
Merged source attributes and domain-specific metadata.
In Ch I
InChI=1S/C14H14O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h3-9,15-17H,1-2H2
Mol Wt
230.263
Cas Id
58436-28-5
Smiles
C1=CC(=CC=C1CCC2=CC(=CC(=C2)O)O)O
Mol Log P
2.588600000000002
Version
v1,v2
In Ch Ikey
HITJFUSPLYBJPE-UHFFFAOYSA-N
Ob Score
87.27387.27301987.27301908
Suppress
1
Mol2 Path
/TCM_database/2007_3d_all/05700.mol2
Reference
658
Num Hdonors
3
Drug Likeness
0.759
Num Hacceptors
3
Isomeric Smiles
C1=CC(=CC=C1CCC2=CC(=CC(=C2)O)O)O
Molecule Weight
230.28
Canonical Smiles
C1=CC(=CC=C1CCC2=CC(=CC(=C2)O)O)O
Herb Alias Names
58436-28-55-[2-(4-hydroxyphenyl)ethyl]benzene-1,3-diol3,4',5-Trihydroxybibenzyl5-(4-hydroxyphenethyl)benzene-1,3-diolDihydro-ResveratrolCHEBI:4582UNII-CBY43AY0TTMFCD25973128CBY43AY0TT
Molecular Weight
230.26
Molecule Formula
C14H14O3
Molecular Formula
C14H14O3
Molecular Formula
C14H14O3
Num Rotatable Bonds
3
Link Ingredient Id
10866.0