Basic information
- CAS
17332-70-6- Standard SMILES
Cc1cccc2c(CC(N)C(=O)O)c[nH]c12- InChIKey
KBOZNJNHBBROHM-UHFFFAOYSA-N- Molecular formula
- C12H14N2O2
- Average molar mass
- 218.25 g/mol
- Monoisotopic mass
- 218.10552769
Overview
7-Methyl-DL-tryptophan has been reported in Aspergillus fumigatus with data available.
Names & identifiers
- Preferred name
- 7-Methyl-DL-tryptophan
- IUPAC
- 2-amino-3-(7-methyl-1H-indol-3-yl)propanoic acid
- English name
- 7-METHYL-DL-TRYPTOPHAN
- Molecular formula
- C12H14N2O2
- Molecular weight
- 218.25
Names & synonyms
7-Methyl-DL-tryptophan17332-70-62-amino-3-(7-methyl-1H-indol-3-yl)propanoic acidDTXSID00278707RefChem:311075DTXCID302298637-methyltryptophanMFCD00056926H-Trp(7-Me)-OH3456-73-3NSC9365CHEMBL554814
Show more names
(S)-2-aMino-3-(7-Methyl-1H-indol-3-yl)propanoic acidDL-Trp(7-Me)-OH7-Methyl-tryptophanTryptophan, 7-methyl-7-METHYL-DL-TRYPTOPHAN USP/EP/BP7-Methyl-DL-tryptophan crystallineDL-2-Amino-3-(7-methylindole)propionic acid
SCHEMBL2033277H-D-Trp(7-Me)-OHNSC-9365DL-2-Amino-3-(7-methylindolyl)propionic acidH-7-Me-DL-Trp-OHH-DL-Trp(7-Me)-OH7-Methyl-DL-tryptophan, crystal7-Methyl-DL-tryptophan, crystalline
Database identifiers
- CAS
17332-70-6、3456-73-3- PubChem CID
- 222688
- DTXSID
DTXSID00278707- ChEMBL
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 79.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 270
Physicochemical properties
- Melting point
- 296 °C · 296 °C (decomp)
- Boiling point
- 448.8 · 448.8±45.0 °C(Predicted)
- Density
- 1.313 · 1.313±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 2.26 · 2.26±0.10(Predicted)
- form
- crystalline
- color
- off-white
- InChI
- InChI=1S/C12H14N2O2/c1-7-3-2-4-9-8(6-14-11(7)9)5-10(13)12(15)16/h2-4,6,10,14H,5,13H2,1H3,(H,15,16)/t10-/m0/s1
- InChIKey
- KBOZNJNHBBROHM-JTQLQIEISA-N
- SMILES
- C(O)(=O)[C@H](CC1C2=C(C(C)=CC=C2)NC=1)N
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
- WGK Germany
- 3 · 3
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
- hs_code
- 2933998090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Applications
Uses7-Methyl-DL-tryptophan (7-Methyltryptophan) is an amino acid derivative, which is a key precursor for biosynthesis of many non-ribosomal peptide antibiotics. 7-Methyl-DL-tryptophan plays an important role in synthesis of high-efficiency antibacterial agents and analogues thereof[1].
Suppliers51 total
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
Syntechem Co.,Ltd[email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
上海沸柏化工科技有限公司021-58955608,2250286 15921236618 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
United Life Science020-82099279 18988941402 · [email protected]
上海泰坦科技股份有限公司400-6009262 15618770481 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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