Cassaidine

AlkaPlorer ID: AK291787

Synonym: None

IUPAC Name: None

Structure

SMILES: CC1/C(=C\C(=O)OCCN(C)C)CCC2C1C(O)CC1C(C)(C)C(O)CCC21C

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InChI: InChI=1S/C24H41NO4/c1-15-16(13-21(28)29-12-11-25(5)6)7-8-17-22(15)18(26)14-19-23(2,3)20(27)9-10-24(17,19)4/h13,15,17-20,22,26-27H,7-12,14H2,1-6H3/b16-13-

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InChIKey: JKPVSFQJGXEMSU-SSZFMOIBSA-N

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Reference

CAS: 26296-41-3

Properties Information

Molecule Weight: 407.59500000000025

TPSA: 70.0

MolLogP: 3.2479000000000022

Number of H-Donors: 2

Number of H-Acceptors: 5

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information