(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 hexanoate
AlkaPlorer ID: AK250942
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] hexanoate
Structure
SMILES: CCCCCC(=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/C26H28N2O8/c1-3-4-5-6-18(30)34-15-8-17-26(22-20(15)36-22)10-13-23(31)27-12(24(32)28(13)17)9-25(26)16(27)7-14(33-11(2)29)19-21(25)35-19/h7-8,12-15,19-22H,3-6,9-10H2,1-2H3/t12-,13-,14+,15+,19-,20-,21-,22-,25-,26-/m0/s1
InChIKey: UGMZFKMKGHFMID-PLRINBPLSA-N
Source
Properties Information
Molecule Weight: 496.51600000000025
TPSA？: 118.28
MolLogP？: 0.9418000000000006
Number of H-Donors: 0
Number of H-Acceptors: 8
RingCount: 9
Activities Information
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