propanamide, 2-amino-n-(2-(5-hydroxy-1h-indol-3-yl)ethyl)-3-mercapto-, (r)-, (r-(r*,r*))-2,3-dihydroxybutanedioate (1:1) (salt)
Basic information
- CAS
36933-14-9- Standard SMILES
N[C@@H](CS)C(=O)NCCc1c[nH]c2ccc(O)cc12.O=C(O)[C@H](O)[C@@H](O)C(=O)O- InChIKey
YEJJAIQMQBESST-MBANBULQSA-N- Molecular formula
- C17H23N3O8S
- Average molar mass
- 429.4 g/mol
- Monoisotopic mass
- 429.12058587
Names & identifiers
- Preferred name
- propanamide, 2-amino-n-(2-(5-hydroxy-1h-indol-3-yl)ethyl)-3-mercapto-, (r)-, (r-(r*,r*))-2,3-dihydroxybutanedioate (1:1) (salt)
- IUPAC
- (2R)-2-amino-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-3-sulfanylpropanamide;(2R,3R)-2,3-dihydroxybutanedioic acid
Names & synonyms
5-Hydroxytryptamide of cysteine tartrate(R)-2-Amino-N-(2-(5-hydroxy-1H-indol-3-yl)ethyl)-3-mercaptopropanamide tartrate36933-14-9Propanamide, 2-amino-N-(2-(5-hydroxy-1H-indol-3-yl)ethyl)-3-mercapto-, (R)-, (R-(R*,R*))-2,3-dihydroxybutanedioate (1:1) (salt)RefChem:374033DTXSID10958124(2R,3R)-2,3-Dihydroxybutanedioic acid--(2R)-2-amino-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-3-sulfanylpropanimidic acid (1/1)2,3-Dihydroxybutanedioic acid--2-amino-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-3-sulfanylpropanimidic acid (1/1)
Database identifiers
- CAS
36933-14-9- PubChem CID
- 215982
- DTXSID
DTXSID10958124
Properties
Computed structural properties
- Topological polar surface area
- 207 Ų
- Hydrogen bond donors
- 9
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 8
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 450
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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