Probestin

AlkaPlorer ID: AK028576

Synonym: None

IUPAC Name: (2R)-1-[(2R)-1-[(2S)-2-[[(2R,3R)-3-amino-2-hydroxy-4-phenylbutanoyl]amino]-4-methylpentanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid

Structure

SMILES: CC(C)C[C@H](N=C(O)[C@H](O)[C@H](N)CC1=CC=CC=C1)C(=O)N1CCC[C@@H]1C(=O)N1CCC[C@@H]1C(=O)O

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InChI: InChI=1S/C26H38N4O6/c1-16(2)14-19(28-23(32)22(31)18(27)15-17-8-4-3-5-9-17)24(33)29-12-6-10-20(29)25(34)30-13-7-11-21(30)26(35)36/h3-5,8-9,16,18-22,31H,6-7,10-15,27H2,1-2H3,(H,28,32)(H,35,36)/t18-,19+,20-,21-,22-/m1/s1

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InChIKey: CEQMEILRVSCKGT-PVIWCNJMSA-N

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Source

Properties Information

Molecule Weight: 502.6120000000004

TPSA: 156.76

MolLogP: 1.355100000000001

Number of H-Donors: 4

Number of H-Acceptors: 6

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information