(4Z)-7-(acetyloxy)-4-ethenyl-6,7,14-trimethyl-3,8-dioxo-2,9-dioxa-14-azatricyclo[9.5.1.0¹?,¹?]heptadeca-4,11-dien-14-ium-17-olate
AlkaPlorer ID: AK319799
Synonym: None
IUPAC Name: (1R,4Z,6S,7S)-7-acetyloxy-4-ethenyl-6,7,14-trimethyl-3,8-dioxo-2,9-dioxa-14-azoniatricyclo[9.5.1.014,17]heptadeca-4,11-dien-17-olate
Structure
SMILES: C=C/C1=C/[C@H](C)[C@](C)(OC(C)=O)C(=O)OCC2=CC[N+]3(C)CC[C@@H](OC1=O)C23[O-]
InChI: InChI=1S/C21H27NO7/c1-6-15-11-13(2)20(4,29-14(3)23)19(25)27-12-16-7-9-22(5)10-8-17(21(16,22)26)28-18(15)24/h6-7,11,13,17H,1,8-10,12H2,2-5H3/b15-11-/t13-,17+,20-,21?,22?/m0/s1
InChIKey: YEGVHSDONMXATH-LKVOMWJFSA-N
Source
Properties Information
Molecule Weight: 405.4470000000002
TPSA？: 101.96
MolLogP？: 0.3722000000000012
Number of H-Donors: 0
Number of H-Acceptors: 7
RingCount: 3
Activities Information
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