Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 12Ingredient: 1Reference: 1Target: 1Links: 14
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 26990
- Core Entity Id
- 33190
- Source Entity Count
- 1
- Preferred Name
- Myristoleicacid
- Name En
- Pubchem Id
- 5281119
- Smiles Canonical
- CCCCC=CCCCCCCCC(=O)O
- Molecular Formula
- C14H26O2
- Molecular Weight
- 226.3600
- Inchikey
- YWWVWXASSLXJHU-AATRIKPKSA-N
- Inchi
- InChI=1S/C14H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h5-6H,2-4,7-13H2,1H3,(H,15,16)/b6-5+
- Isomeric Smiles
- CCCC/C=C/CCCCCCCC(=O)O
- Cas Id
- 544-64-9
- Ob Score
- 38.4800
- Mol Logp
- 4.5481
- Num H Donors
- 1
- Num H Acceptors
- 1
- Num Rotatable Bonds
- 11
- Drug Likeness
- 0.4140
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Myristelaidic Acid
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
Myristelaidic Acid
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
Myristelaidic acid
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Myristelaidic acid
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
Myristelaidic acid
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
Myristelaidic acid
Role
preferred
Source
TCMBank
Preferred
Yes
Name
Myristoleic acid
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
Myristoleicacid
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
Myristoleicacid
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Myristoleicacid
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
myristoleicacid
Role
preferred
Source
TCMBank
Preferred
Yes
Name
(9E)-9-Tetradecenoic acid
Role
alias
Source
HERB_v2
Preferred
No
Name
(9E)-9-Tetradecenoic acid
Role
alias
Source
itcmdb_public
Preferred
No
Name
(9E)-9-Tetradecenoic acid
Role
alias
Source
TCMBank
Preferred
No
Name
(9E)-tetradec-9-enoic acid
Role
alias
Source
itcmdb_public
Preferred
No
Name
(9E)-tetradec-9-enoic acid
Role
alias
Source
TCMBank
Preferred
No
Name
(9E)-tetradec-9-enoic acid
Role
alias
Source
HERB_v2
Preferred
No
Name
(9E)-tetradecenoic acid
Role
alias
Source
TCMBank
Preferred
No
Name
(9Z)-tetradec-9-enoic acid
Role
alias
Source
HERB_v2
Preferred
No
Name
(9Z)-tetradec-9-enoic acid
Role
alias
Source
itcmdb_public
Preferred
No
Name
(E)-9-Tetradecenoicacid
Role
alias
Source
HERB_v2
Preferred
No
Name
(E)-9-Tetradecenoicacid
Role
alias
Source
itcmdb_public
Preferred
No
Name
(E)-tetradec-9-enoate
Role
alias
Source
TCMBank
Preferred
No
Name
(E)-tetradec-9-enoic acid
Role
alias
Source
TCMBank
Preferred
No
Name
(E)-tetradec-9-enoic acid
Role
alias
Source
HERB_v2
Preferred
No
Name
(E)-tetradec-9-enoic acid
Role
alias
Source
itcmdb_public
Preferred
No
Name
(Z)-Tetradec-9-enoic acid
Role
alias
Source
HERB_v2
Preferred
No
Name
(Z)-Tetradec-9-enoic acid
Role
alias
Source
itcmdb_public
Preferred
No
Name
(z)-9-tetradecenoic acid
Role
alias
Source
itcmdb_public
Preferred
No
Name
(z)-9-tetradecenoic acid
Role
alias
Source
HERB_v2
Preferred
No
Name
0WAJ36526B
Role
alias
Source
TCMBank
Preferred
No
Name
50286-30-1
Role
alias
Source
HERB_v2
Preferred
No
Name
50286-30-1
Role
alias
Source
TCMBank
Preferred
No
Name
50286-30-1
Role
alias
Source
itcmdb_public
Preferred
No
Name
544-64-9
Role
alias
Source
HERB_v2
Preferred
No
Name
544-64-9
Role
alias
Source
itcmdb_public
Preferred
No
Name
9-Tetradecenoic acid
Role
alias
Source
HERB_v2
Preferred
No
Name
9-Tetradecenoic acid
Role
alias
Source
itcmdb_public
Preferred
No
Name
9-Tetradecenoic acid, (9E)-
Role
alias
Source
itcmdb_public
Preferred
No
Name
9-Tetradecenoic acid, (9E)-
Role
alias
Source
TCMBank
Preferred
No
Name
9-Tetradecenoic acid, (9E)-
Role
alias
Source
HERB_v2
Preferred
No
Name
9-Tetradecenoic acid, (9Z)-
Role
alias
Source
HERB_v2
Preferred
No
Name
9-Tetradecenoic acid, (9Z)-
Role
alias
Source
itcmdb_public
Preferred
No
Name
9-cis-Tetradecenoic acid
Role
alias
Source
itcmdb_public
Preferred
No
Name
9-cis-Tetradecenoic acid
Role
alias
Source
HERB_v2
Preferred
No
Name
9E-Tetradecenoate
Role
alias
Source
TCMBank
Preferred
No
Name
9E-tetradecenoic acid
Role
alias
Source
itcmdb_public
Preferred
No
Name
9E-tetradecenoic acid
Role
alias
Source
HERB_v2
Preferred
No
Name
9Z-tetradecenoic acid
Role
alias
Source
HERB_v2
Preferred
No
Name
9Z-tetradecenoic acid
Role
alias
Source
itcmdb_public
Preferred
No
Name
AC1NSMNY
Role
alias
Source
TCMBank
Preferred
No
Name
AKOS032954684
Role
alias
Source
TCMBank
Preferred
No
Name
C14:1n-5
Role
alias
Source
HERB_v2
Preferred
No
Name
C14:1n-5
Role
alias
Source
TCMBank
Preferred
No
Name
C14:1n-5
Role
alias
Source
itcmdb_public
Preferred
No
Name
CHEBI:131381
Role
alias
Source
TCMBank
Preferred
No
Name
E-9-Tetradecenoic acid
Role
alias
Source
TCMBank
Preferred
No
Name
LMFA01030250
Role
alias
Source
TCMBank
Preferred
No
Name
M5034_SIGMA
Role
alias
Source
TCMBank
Preferred
No
Name
MolPort-003-958-761
Role
alias
Source
TCMBank
Preferred
No
Name
Myristelaidic acid
Role
alias
Source
TCMBank
Preferred
No
Name
Myristoleic acid
Role
alias
Source
itcmdb_public
Preferred
No
Name
Myristoleic acid
Role
alias
Source
HERB_v2
Preferred
No
Name
Myristoleinsaure
Role
alias
Source
TCMBank
Preferred
No
Name
SCHEMBL109271
Role
alias
Source
TCMBank
Preferred
No
Name
SCHEMBL156569
Role
alias
Source
TCMBank
Preferred
No
Name
Tetradecenoic acid C
Role
alias
Source
TCMBank
Preferred
No
Name
UNII-0WAJ36526B
Role
alias
Source
TCMBank
Preferred
No
Name
YWWVWXASSLXJHU-AATRIKPKSA-N
Role
alias
Source
TCMBank
Preferred
No
Name
ZINC1531062
Role
alias
Source
TCMBank
Preferred
No
Name
cis-9-tetradecenoic acid
Role
alias
Source
HERB_v2
Preferred
No
Name
cis-9-tetradecenoic acid
Role
alias
Source
itcmdb_public
Preferred
No
Name
myristelaidate
Role
alias
Source
TCMBank
Preferred
No
Name
myristoleic acid
Role
alias
Source
TCMBank
Preferred
No
Name
tetradec-9-enoic acid
Role
alias
Source
TCMBank
Preferred
No
Name
trans-9-Tetradecenoate
Role
alias
Source
TCMBank
Preferred
No
Name
trans-9-Tetradecenoic acid
Role
alias
Source
HERB_v2
Preferred
No
Name
trans-9-Tetradecenoic acid
Role
alias
Source
TCMBank
Preferred
No
Name
trans-9-Tetradecenoic acid
Role
alias
Source
itcmdb_public
Preferred
No
Aliases
Additional names normalized into the restored final schema.
Myristelaidic AcidMyristoleic acid(9E)-9-Tetradecenoic acid(9E)-tetradec-9-enoic acid(9E)-tetradecenoic acid(9Z)-tetradec-9-enoic acid(E)-9-Tetradecenoicacid(E)-tetradec-9-enoate(E)-tetradec-9-enoic acid(Z)-Tetradec-9-enoic acid(z)-9-tetradecenoic acid0WAJ36526B50286-30-1544-64-99-Tetradecenoic acid9-Tetradecenoic acid, (9E)-9-Tetradecenoic acid, (9Z)-9-cis-Tetradecenoic acid9E-Tetradecenoate9E-tetradecenoic acid9Z-tetradecenoic acidAC1NSMNYAKOS032954684C14:1n-5CHEBI:131381E-9-Tetradecenoic acidLMFA01030250M5034_SIGMAMolPort-003-958-761MyristoleinsaureSCHEMBL109271SCHEMBL156569Tetradecenoic acid CUNII-0WAJ36526BYWWVWXASSLXJHU-AATRIKPKSA-NZINC1531062cis-9-tetradecenoic acidmyristelaidatetetradec-9-enoic acidtrans-9-Tetradecenoatetrans-9-Tetradecenoic acid
Cross References
Trusted external identifiers retained for this final record.
Cas
544-64-9
Herb
HBIN036156HBIN036167
Npass
NPC116003NPC281245
Tcmid
1519725449
Tcmsp
MOL012144
Sym Map
SMIT12942SMIT16798SMIT18866
Pub Chem
52811195312402
Tcmbank
TCMBANKIN000581TCMBANKIN001284
Etcm Ingredient
Myristelaidic acidMyristoleic acid
Itcmdb Generated
ITX-INGREDIENT-135326498CB3ITX-INGREDIENT-CD6765F824A4
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
In Ch I
InChI=1S/C14H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h5-6H,2-4,7-13H2,1H3,(H,15,16)/b6-5+InChI=1S/C14H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h5-6H,2-4,7-13H2,1H3,(H,15,16)/b6-5-
Mol Wt
226.3599999999999
Cas Id
544-64-9
Smiles
CCCCC=CCCCCCCCC(=O)O
Mol Log P
4.548100000000003
Version
v1,v2
In Ch Ikey
YWWVWXASSLXJHU-AATRIKPKSA-NYWWVWXASSLXJHU-WAYWQWQTSA-N
Ob Score
38.4838.48043738.48043741
Suppress
0
Num Hdonors
1
Drug Likeness
0.414
Num Hacceptors
1
Isomeric Smiles
CCCC/C=C/CCCCCCCC(=O)OCCCC/C=C\CCCCCCCC(=O)O
Molecule Weight
226.4
Canonical Smiles
CCCCC=CCCCCCCCC(=O)O
Herb Alias Names
50286-30-1(E)-tetradec-9-enoic acid9-Tetradecenoic acid, (9E)-9E-tetradecenoic acidtrans-9-Tetradecenoic acidC14:1n-5(E)-9-Tetradecenoicacid(9E)-9-Tetradecenoic acid(9E)-tetradec-9-enoic acid
Molecular Weight
226.190
Molecular Weight
226.35226.35 g/mol
Molecular Formula
C14H26O2
Molecular Formula
C14H26O2
Molecular Formula
C14H26O2
Num Rotatable Bonds
11
Fda Maximum Daily Dose (Fdamdd)
0.0140.025
Quantitative Estimate Of Drug Likeness（Qed）
0.414