Imperialine
AlkaPlorer ID: AK000304
Synonym: '', 'Osnovanine', 'Raddeanine', 'Peiminine', 'Cevan-6-one, 3,20-dihydroxy-, (3-beta,5-alpha,17-beta)-', 'Imperialine', 'Yubeinine', 'Sipeimine', 'Zhebeinone', 'Kashmirine', 'Fritillarine', 'Verticinone'
IUPAC Name: (1R,2S,6R,9S,10S,11S,14S,15R,18S,20S,23R,24S)-10,20-dihydroxy-6,10,23-trimethyl-4-azahexacyclo[12.11.0.02,11.04,9.015,24.018,23]pentacosan-17-one
Structure
SMILES: C[C@@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@@H]1[C@]2(C)O
InChI: InChI=1S/C27H43NO3/c1-15-4-7-25-27(3,31)21-6-5-17-18(20(21)14-28(25)13-15)11-22-19(17)12-24(30)23-10-16(29)8-9-26(22,23)2/h15-23,25,29,31H,4-14H2,1-3H3/t15-,16+,17-,18-,19-,20+,21+,22+,23-,25+,26-,27+/m1/s1
InChIKey: IQDIERHFZVCNRZ-KPKHNLGMSA-N
Source
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Properties Information
Molecule Weight: 429.64500000000027
TPSA？: 60.77000000000001
MolLogP？: 3.8863000000000034
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 6
Activities Information
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