Basic information
- CAS
26265-99-6- Standard SMILES
CCCCCC/C=C\CCCCCCCCC(=O)O- InChIKey
GDTXICBNEOEPAZ-FPLPWBNLSA-N- Molecular formula
- C17H32O2
- Average molar mass
- 268.4 g/mol
- Monoisotopic mass
- 268.24023026
Overview
(10Z)-heptadecenoic acid is the cis-isomer of 10-heptadecenoic acid. It has a role as a plant metabolite. It is a conjugate acid of a (10Z)-heptadecenoate.
Names & identifiers
- Preferred name
- Heptadecenoic Acid
- IUPAC
- (Z)-heptadec-10-enoic acid
- English name
- CIS-10-HEPTADECENOIC ACID
- Molecular formula
- C17H32O2
- Molecular weight
- 268.43
Names & synonyms
cis-10-Heptadecenoic acid29743-97-3(Z)-heptadec-10-enoic acid(10Z)-10-Heptadecenoic acid(10Z)-heptadec-10-enoic acidH8A6DO053EDTXSID80102080310-Heptadecenoic acid (17:1(n-7))heptadecenoic acidsfatty acid 17:1RefChem:783610CHEBI:36001
Show more names
cis-10-Hepta1O-HEPTADECENOICC17:1 (CIS-10) ACIDcis-10-Heptadecenoic-Heptadec-10-enoic acid(Z)-10-Heptadecenoic acid10-cis-Heptadecenoic acid
DTXCID001505188C17:128040-00-8636-906-326265-99-6HEPTADECENOIC ACID10Z-heptadecenoic acidUNII-H8A6DO053E
Database identifiers
- CAS
26265-99-6、29743-97-3- PubChem CID
- 5312435
- DTXSID
DTXSID801020803- ChEBI
CHEBI:75094- UNII
- H8A6DO053E
Properties
Computed structural properties
- XLogP
- 6.9
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 14
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 221
Experimental & physicochemical properties
LipidsFatty Acyls [FA] -> Fatty Acids and Conjugates [FA01] -> Unsaturated fatty acids [FA0103]
Physicochemical properties
- Boiling point
- 354 · 354.0±11.0 °C(Predicted)
- Density
- 0.902 · 0.902±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C
- solubility
- Chloroform (Slightly), DMSO (Slightly), Ethanol
- form
- Colourless Solution
- pka
- 4.78 · 4.78±0.10(Predicted)
- color
- Colorless to light yellow
- Stability
- Light Sensitive, Volatile
- InChI
- 1S/C17H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19/h7-8H,2-6,9-16H2,1H3,(H,18,19)/b8-7-
- InChIKey
- GDTXICBNEOEPAZ-FPLPWBNLSA-N
- SMILES
- CCCCCC\C=C/CCCCCCCCC(O)=O
- FDA UNII
- 8 A6DO053E · H8A6DO053E
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Storage Class
- 10 - Combustible liquids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P305+P351+P338
Chemistry & industry
Pharmacology
Tissue LocationsPlacenta
Cellular LocationsMembrane
Applications
Descriptioncis-10-Heptadecenoic acid is a C17:1 monounsaturated fatty acid that is a minor constituent of ruminant fats. It has been examined for potential antitumor activity and was reported to inhibit HL-60 cell proliferation with an IC50 value of 302 μM and to prevent LPS-induced tumor necrosis factor production from mouse macrophages.
Usescis-10-Heptadecenoic Acid, is a monounsaturated fatty acid that is a minor constituent of ruminant fats. It has also shown potential antitumor activity and was reported to inhibit HL-60 cell proliferation with an IC50 value of 302 μM and to prevent LPS-induced tumor necrosis factor production from mouse macrophages.
Suppliers58 total
阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Hangzhou Collab Medicine Co.,Ltd.+86-15936229464 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海优宁维生物科技股份有限公司15921930842 15921930842 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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