(1S,2R,4S,5R,10S,12S,13R,15S,16R,21S)-16-(acetyloxy)-9,20-dioxo-3,14-dioxa-8,19-diazaoctacyclo[10.10.0.0¹,⁷.0²,⁴.0⁸,²¹.0¹⁰,¹⁹.0¹²,¹⁸.0¹³,¹⁵]docosa-6,17-dien-5-yl butanoate
AlkaPlorer ID: AK157328
Synonym: None
IUPAC Name: [(1S,2R,4S,5R,10S,12S,13R,15S,16R,21S)-16-acetyloxy-9,20-dioxo-3,14-dioxa-8,19-diazaoctacyclo[10.10.0.01,7.02,4.08,21.010,19.012,18.013,15]docosa-6,17-dien-5-yl] butanoate
Structure
SMILES: CCCC(=O)O[C@@H]1C=C2N3C(=O)[C@@H]4C[C@]56C(=C[C@@H](OC(C)=O)[C@@H]7O[C@@H]75)N4C(=O)[C@@H]3C[C@@]26[C@H]2O[C@@H]12
InChI: InChI=1S/C24H24N2O8/c1-3-4-16(28)32-13-6-15-24(20-18(13)34-20)8-11-21(29)25-10(22(30)26(11)15)7-23(24)14(25)5-12(31-9(2)27)17-19(23)33-17/h5-6,10-13,17-20H,3-4,7-8H2,1-2H3/t10-,11-,12+,13+,17-,18-,19-,20-,23-,24-/m0/s1
InChIKey: LBTFEMXTTNLPGV-FCUXFDRLSA-N
Source
Properties Information
Molecule Weight: 468.4620000000002
TPSA？: 118.28
MolLogP？: 0.1616000000000013
Number of H-Donors: 0
Number of H-Acceptors: 8
RingCount: 9
Activities Information
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