Heimidine
AlkaPlorer ID: AK037424
Synonym: '', 'Lythridine', 'lythridine', 'heimidine'
IUPAC Name: (1S,13S,17S,19S)-9,13-dihydroxy-4,5-dimethoxy-16-oxa-24-azapentacyclo[15.7.1.18,12.02,7.019,24]hexacosa-2,4,6,8,10,12(26)-hexaen-15-one
Structure
SMILES: COC1=CC2=C(C=C1OC)[C@@H]1C[C@H](C[C@@H]3CCCCN31)OC(=O)C[C@H](O)C1=CC2=C(O)C=C1
InChI: InChI=1S/C26H31NO6/c1-31-24-12-18-19(13-25(24)32-2)21-11-17(10-16-5-3-4-8-27(16)21)33-26(30)14-23(29)15-6-7-22(28)20(18)9-15/h6-7,9,12-13,16-17,21,23,28-29H,3-5,8,10-11,14H2,1-2H3/t16-,17-,21-,23-/m0/s1
InChIKey: AZYBQXPITOLDBL-PUEVPBCXSA-N
Source
Properties Information
Molecule Weight: 453.5350000000002
TPSA？: 88.46000000000001
MolLogP？: 4.1147000000000045
Number of H-Donors: 2
Number of H-Acceptors: 7
RingCount: 5
Activities Information
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