3-fluoro-N-[(3S,5R,9S,11S)-5-hydroxy-2,8-dioxo-1,7-diazatricyclo[7.4.0.0³,⁷]tridecan-11-yl]benzamide
AlkaPlorer ID: AK400839
Synonym: None
IUPAC Name: 3-fluoro-N-[(3S,5R,9S,11S)-5-hydroxy-2,8-dioxo-1,7-diazatricyclo[7.4.0.03,7]tridecan-11-yl]benzamide
Structure
SMILES: O=C(N[C@H]1CCN2C(=O)[C@@H]3C[C@@H](O)CN3C(=O)[C@@H]2C1)C1=CC=CC(F)=C1
InChI: InChI=1S/C18H20FN3O4/c19-11-3-1-2-10(6-11)16(24)20-12-4-5-21-14(7-12)18(26)22-9-13(23)8-15(22)17(21)25/h1-3,6,12-15,23H,4-5,7-9H2,(H,20,24)/t12-,13+,14-,15-/m0/s1
InChIKey: HLVHTHNIXWRYAG-XGUBFFRZSA-N
Reference
Malayenolides A−D, Novel Diterpenes from the Indonesian Sea Pen <i>Veretillum malayense</i>
PubChem CID: 40467491
SuperNatural Ⅲ: SN0129154-02
Source
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Properties Information
Molecule Weight: 361.3730000000001
TPSA？: 89.94999999999999
MolLogP？: -0.1094999999999988
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 4
Activities Information
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