Basic information
- CAS
3493-13-8- Standard SMILES
C[S+](CCC(N)C(=O)O)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O.[I-]- InChIKey
XQMWYLXPEGFCFT-UHFFFAOYSA-N- Molecular formula
- C15H23IN6O5S
- Average molar mass
- 526.4 g/mol
- Monoisotopic mass
- 526.04954
Names & identifiers
- Preferred name
- S-(5'-deoxy-5'-adenosyl)methionine iodide
- IUPAC
- (3-amino-3-carboxypropyl)-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl]-methylsulfanium iodide
- English name
- S-Adenosyl-L-methionine iodide salt
- Molecular formula
- C15H23IN6O5S
- Molecular weight
- 526.35
Names & synonyms
S-(5'-Deoxy-5'-adenosyl)methionine iodideEINECS 222-486-5RefChem:884153222-486-53493-13-8S-ADENOSYL-L-METHIONINE IODIDE SALT((S)-3-amino-3-carboxypropyl)(((2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl)(methyl)sulfonium iodideAKOS024284735ST0788762-amino-6-[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]-5-methyl-5-thiahexa noic acid, iodideSAM-Iadomet
Show more names
AdoMet, SAMSAM iodide saltSAM-E IODIDE SALTS-adenosylmethioneS-ADENOSYLMETHIONINE IODIDES-ADENOSYL-L-METHIONINE IODIDES-ADENOSYL METHIONINE IODIDE SALTS-(5'-Adenosyl)-L-methionine iodide
Database identifiers
Properties
Computed structural properties
- Topological polar surface area
- 184 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 533
Physicochemical properties
- storage temp.
- -20 °C · -20°C
- solubility
- 2 O: · H2O: 100 mg/mL
- form
- powder
- color
- white to off-white
- Water Solubility
- 2 O: · H2O: 100mg/mL
- BRN
- 4120787 · 4120787
- InChIKey
- XQMWYLXPEGFCFT-JKRVOTFBNA-N
- SMILES
- N1(C=NC2C(N)=NC=NC1=2)[C@H]1[C@H](O)[C@H](O)[C@@H](C[S+](C)CC[C@H](N)C(=O)O)O1.[I-] |&1:10,11,13,15,21,r|
- UNSPSC Code
- 12352209 · 12352209
- NACRES
- 26 · NA.26
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 317 · H317
- Precautionary statements
- 261 · P261-P272-P280-P302+P352-P333+P313-P362+P364
- PPE
- 95 · Eyeshields, Faceshields, Gloves, type N95 (US)
- Hazard Codes
- Xi
- Risk Statements
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
H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Sens. 1 (100%)
Safety data
- F
- 8-10-23
- PPE
- Eyeshields, Faceshields, Gloves, type N95 (US)
- wgk
- 3
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 22-24/25-36-26
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H317
- Hazard Classifications
- Skin Sens. 1
- Precautionary statements
- P261-P272-P280-P302+P352-P333+P313-P362+P364
Chemistry & industry
Applications
UsesS-(5′-Adenosyl)-L-methionine (SAM, AdoMet) is used as a primary methyl donor molecule in mammalian cell culture and the first step metabolite in methionine biosynthesis.
Suppliers41 total
湖南韵邦生物科技股份有限公司0731-88532326 13319508186 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
武汉众志诚生物技术有限公司13628624121 13628604890 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13318593351 · [email protected]
武汉吉业升化工有限公司13545274181 15307147230 · [email protected]
United Life Science020-82099279 18988968278 · [email protected]
上海梅凯科技有限公司021-68689288 15300790979 · [email protected]
烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
成都诺维生物科技有限公司028-81458053 · [email protected] [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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