(R)-S-adenosyl-L-methionine (Q27115647)

inferred from SMILES

mass

399.144501 dalton

1 reference

[(3S)-3-Amino-3-carboxypropyl]{[(2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydro-2-furanyl]methyl}methylsulfonium (English)

(S)-S-adenosyl-L-methionine

6 October 2016

stereoisomer of

2 references

inferred from InChIKey

inferred from InChI

S-adenosyl-D-methionine

1 reference

inferred from InChI

chemical formula

C₁₅H₂₃N₆O₅S

0 references

canonical SMILES

C[S+](CCC(C(=O)O)(N)[H])CC1(C(C(C(N2C=NC3=C(N)N=CN=C32)(O1)[H])(O)[H])(O)[H])[H]

1 reference

(R)-S-adenosyl-L-methionine (English)

6 October 2016

isomeric SMILES

C[S@+](CC[C@@](C(=O)O)(N)[H])C[C@@]1([C@]([C@]([C@](N2C=NC3=C(N)N=CN=C32)(O1)[H])(O)[H])(O)[H])[H]

1 reference

(R)-S-adenosyl-L-methionine (English)

InChI=1S/C15H22N6O5S/c1-27(3-2-7(16)15(24)25)4-8-10(22)11(23)14(26-8)21-6-20-9-12(17)18-5-19-13(9)21/h5-8,10-11,14,22-23H,2-4,16H2,1H3,(H2-,17,18,19,24,25)/p+1/t7-,8+,10+,11+,14+,27+/m0/s1

6 October 2016

Identifiers

InChI

1 reference

(R)-S-adenosyl-L-methionine (English)

MEFKEPWMEQBLKI-TYYLHDHTSA-O

6 October 2016

InChIKey

2 references

(R)-S-adenosyl-L-methionine (English)

6 October 2016

stated in

ChEBI release 2020-09-01

1 reference

[(3S)-3-Amino-3-carboxypropyl]{[(2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydro-2-furanyl]methyl}methylsulfonium (English)

reason for deprecated rank

6 October 2016

PubChem CID

34755

applies to other chemical entity

intended subject of deprecated statement

S-adenosylmethionine

0 references

Reaxys registry number

9671724

1 reference

(R)-S-adenosyl-L-methionine (English)

6 October 2016

ChEBI ID

33440

mapping relation type

2 references

(R)-S-adenosyl-L-methionine (English)

matched by identifier from

6 October 2016

International Chemical Identifier

InChI

InChI=1S/C15H22N6O5S/c1-27(3-2-7(16)15(24)25)4-8-10(22)11(23)14(26-8)21-6-20-9-12(17)18-5-19-13(9)21/h5-8,10-11,14,22-23H,2-4,16H2,1H3,(H2-,17,18,19,24,25)/p+1/t7-,8+,10+,11+,14+,27+/m0/s1

142093

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C15H22N6O5S/c1-27(3-2-7(16)15(24)25)4-8-10(22)11(23)14(26-8)21-6-20-9-12(17)18-5-19-13(9)21/h5-8,10-11,14,22-23H,2-4,16H2,1H3,(H2-,17,18,19,24,25)/p+1/t7-,8+,10+,11+,14+,27+/m0/s1

SureChEMBL ID

SCHEMBL59293

2 references