Fulvine

AlkaPlorer ID: AK032881

Synonym: '', 'Fulvine'

IUPAC Name: (1S,4R,5R,6S,16R)-5-hydroxy-4,5,6-trimethyl-2,8-dioxa-13-azatricyclo[8.5.1.013,16]hexadec-10-ene-3,7-dione

Structure

SMILES: C[C@@H]1C(=O)OCC2=CCN3CC[C@H](OC(=O)[C@H](C)[C@]1(C)O)[C@@H]23

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InChI: InChI=1S/C16H23NO5/c1-9-14(18)21-8-11-4-6-17-7-5-12(13(11)17)22-15(19)10(2)16(9,3)20/h4,9-10,12-13,20H,5-8H2,1-3H3/t9-,10+,12+,13-,16-/m1/s1

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InChIKey: PSUFRPOAICRSTC-FJHONVIPSA-N

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Reference

PubChem CID: 162919662

SuperNatural Ⅲ: SN0294241-02

NPASS: NPC90529

Properties Information

Molecule Weight: 309.362

TPSA: 76.07

MolLogP: 0.4925

Number of H-Donors: 1

Number of H-Acceptors: 6

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information