(1R,2S,6R,9S,10R,11R,14R,18S,20R,23S,25S)-6,10,23-trimethyl-4-azahexacyclo[12.11.0.0²,¹¹.0⁴,⁹.0¹⁵,²⁴.0¹⁸,²³]pentacos-15(24)-ene-20,25-diol

AlkaPlorer ID: AK261034

Synonym: None

IUPAC Name: (1R,2S,6R,9S,10R,11R,14R,18S,20R,23S,25S)-6,10,23-trimethyl-4-azahexacyclo[12.11.0.02,11.04,9.015,24.018,23]pentacos-15(24)-ene-20,25-diol

Structure

SMILES: C[C@@H]1CC[C@H]2[C@H](C)[C@@H]3CC[C@H]4C5=C([C@@H](O)[C@H]4[C@H]3CN2C1)[C@@]1(C)CC[C@@H](O)C[C@@H]1CC5

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InChI: InChI=1S/C27H43NO2/c1-15-4-9-23-16(2)19-7-8-20-21-6-5-17-12-18(29)10-11-27(17,3)25(21)26(30)24(20)22(19)14-28(23)13-15/h15-20,22-24,26,29-30H,4-14H2,1-3H3/t15-,16-,17+,18-,19+,20+,22+,23+,24-,26+,27+/m1/s1

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InChIKey: RKRBZPKEVUKTID-NUOGNNJFSA-N

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Source

Properties Information

Molecule Weight: 413.6460000000003

TPSA: 43.7

MolLogP: 4.627400000000004

Number of H-Donors: 2

Number of H-Acceptors: 3

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information