NA

ID: ALA4861360

Chembl Id: CHEMBL4861360

PubChem CID: 164615315

Max Phase: Preclinical

Molecular Formula: C53H88N16O22S3

Molecular Weight: 1397.58

Molecule Type: Unknown

Names and Identifiers

Canonical SMILES:  CSCC[C@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CS)NC(C)=O)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(N)=O

Standard InChI:  InChI=1S/C53H88N16O22S3/c1-24(2)16-31(43(56)81)66-48(86)29(10-12-41(77)78)65-53(91)36(23-93)62-39(74)20-58-46(84)33(18-42(79)80)68-49(87)30(13-15-94-5)61-38(73)19-57-45(83)28(9-11-40(75)76)64-51(89)34(21-70)69-44(82)25(3)59-47(85)27(8-6-7-14-54)63-50(88)32(17-37(55)72)67-52(90)35(22-92)60-26(4)71/h24-25,27-36,70,92-93H,6-23,54H2,1-5H3,(H2,55,72)(H2,56,81)(H,57,83)(H,58,84)(H,59,85)(H,60,71)(H,61,73)(H,62,74)(H,63,88)(H,64,89)(H,65,91)(H,66,86)(H,67,90)(H,68,87)(H,69,82)(H,75,76)(H,77,78)(H,79,80)/t25-,27-,28-,29-,30-,31-,32-,33-,34-,35-,36-/m0/s1

Standard InChI Key:  ZASGMCXBBNAQLB-SPGSVKGFSA-N

Alternative Forms

1. Parent:

   

   ALA4861360

   ---

Molecule Features

Natural Product: No

Oral: No

Chemical Probe: No

Parenteral: No

Molecule Type: Unknown

Topical: No

First In Class: No

Black Box: No

Chirality: No

Availability: No

Prodrug: No

Calculated Properties

Molecular Weight: 1397.58

Molecular Weight (Monoisotopic): 1396.5421

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References

1.  (2015)  Antagonistic peptides for frizzled-1 and frizzled-2, 

2.  (2013)  Antagonistic peptides for frizzled-1 and frizzled-2, 

Source

Source(1):

• Patent Bioactivity Data