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Basic information
- CAS
173106-38-2- Standard SMILES
C=C(CSCC(=O)O)[C@@H]1CC[C@]2(C(=O)NCCCCCCCCCCC(=O)O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12- InChIKey
MOXUSMLQESTWJB-MEUQDLEQSA-N- Molecular formula
- C43H71NO6S
- Average molar mass
- 730.109 g/mol
- Monoisotopic mass
- 729.50020999
Names & identifiers
- Preferred name
- 11-({29-[(Carboxymethyl)sulfanyl]-3,28-dihydroxylup-20(30)-en-28-ylidene}amino)undecanoic acid
- IUPAC
- 11-{[(19R)-29-[(Carboxymethyl)sulfanyl]-3beta,28-dihydroxylup-20(30)-en-28-ylidene]amino}undecanoic acid
Database identifiers
- CAS
173106-38-2- PubChem CID
- 463512
- DTXSID
DTXSID80938312- Nikkaji
- J739.637F
Related reactions
0 records
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Compound notes
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