Research chemical
CAS Number: 127902-98-1
![(2S,2'S)-2,2'-[[(1R)-1-Carboxy-1,4-butanediyl]bis[imino(2-oxo-2,1-ethanediyl)]]bis[2-hydroxybutanedioic acid] molecular structure, CAS 127902-98-1](/structure-images/127902-98-1.png?v=struct-v2)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
145710536
Exact Mass
480.122753
InChIKey
VJSIXUQLTJCRCS-INUFPEASSA-N
IUPAC Name
(2S)-2-[2-[[(4R)-4-carboxy-4-[[(3S)-3,4-dicarboxy-3-hydroxybutanoyl]amino]butyl]amino]-2-oxoethyl]-2-hydroxybutanedioic acid
SMILES String
O=C(O)C[C@@](O)(CC(=O)NCCC[C@@H](NC(=O)C[C@](O)(CC(=O)O)C(=O)O)C(=O)O)C(=O)O
No physical property values available.
Catalog navigation
Other public CAS pages in this catalog. These links support navigation across additional intermediates and do not imply equivalence, availability, or shared use.
(2S,2'S)-2,2'-[[(1R)-1-Carboxy-1,4-butanediyl]bis[imino(2-oxo-2,1-ethanediyl)]]bis[2-hydroxybutanedioic acid] is identified by CAS 127902-98-1, with molecular formula C17H24N2O14, molecular weight 480.4, InChIKey VJSIXUQLTJCRCS-INUFPEASSA-N.
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
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Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
33
H-bond acceptors
16
H-bond donors
9
Rotatable bonds
16
Ring count
0
Aromatic rings
0
Topological polar surface area
285.16 Ų
Computed LogP
-3.19
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
No
Structure family
organic nitrogen ligand candidate
Precious metal motif
No
Transition metal motif
No
Phosphine ligand motif
No
N-heterocycle motif
No
Boronic acid motif
No
Computed structure descriptors generated from molecular structure. These are not experimental physical property values, supplier specifications, SDS data, or bioactivity claims.
Structural features
(2S,2'S)-2,2'-[[(1R)-1-Carboxy-1,4-butanediyl]bis[imino(2-oxo-2,1-ethanediyl)]]bis[2-hydroxybutanedioic acid] (CAS 127902-98-1) is maintained as a commercial cas reference with formula C17H24N2O14, molecular weight 480. 40 g/mol, PubChem CID 145710536.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
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Documentation needs
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Safety and handling reference content is available through documentation requests.
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