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Basic information
- CAS
173106-37-1- Standard SMILES
C=C(CSCCN(CC)CC)[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
UIRZXZJPFRPXLS-QRXCWXLESA-N- Molecular formula
- C47H82N2O4S
- Average molar mass
- 771.25 g/mol
- Monoisotopic mass
- 770.5995301
Names & identifiers
- Preferred name
- 11-{[29-{[2-(Diethylamino)ethyl]sulfanyl}-3,28-dihydroxylup-20(30)-en-28-ylidene]amino}undecanoic acid
- IUPAC
- 11-{[(19R)-29-{[2-(Diethylamino)ethyl]sulfanyl}-3beta,28-dihydroxylup-20(30)-en-28-ylidene]amino}undecanoic acid
Database identifiers
- CAS
173106-37-1- PubChem CID
- 463511
- DTXSID
DTXSID20938311- Nikkaji
- J739.636H
Related reactions
0 records
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Compound notes
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