Compound Summary


  Compound Information
 WIN 62,577

Compound Name:

WIN 62,577

Compound CID:

15118529

Synonyms:

WIN 62,577

WIN-62577

138091-43-7

144177-32-2

(1R,3aS,3bR,15aR,15bS,17aS)-1-ethynyl-15a,17a-dimethyl-2,3,3a,3b,4,5,15,15a,15b,16,17,17a-dodecahydro-1H-benzo4,5imidazo2,1-bcyclopenta5,6naphtho1,2-gquinazolin-1-ol

More...

Iupac Name:

(3R,4S,7S,8R,11S,12R)-8-ethynyl-3,7-dimethyl-18,20,27-triazaheptacyclo[15.11.0.03,15.04,12.07,11.019,27.021,26]octacosa-1(28),15,17,19,21,23,25-heptaen-8-ol

InChI:

InChI=1S/C29H31N3O/c1-4-29(33)14-12-22-20-10-9-19-15-24-18(16-27(19,2)21(20)11-13-28(22,29)3)17-32-25-8-6-5-7-23(25)30-26(32)31-24/h1,5-8,15,17,20-22,33H,9-14,16H2,2-3H3/t20-,21+,22+,27+,28+,29+/m1/s1

InChIKey:

YBCYJDNOPAFFOW-XOAARHKISA-N

Canonical Smiles:

CC12CCC3C(C1CCC2(C#C)O)CCC4=CC5=NC6=NC7=CC=CC=C7N6C=C5CC34C

Isomeric Smiles:

C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=CC5=NC6=NC7=CC=CC=C7N6C=C5C[C@]34C

Molecular Weight:

437.6

Molecular Formula:

C29H31N3O

  Compound Structure
 2D Structure:
 3D Structure:
  Computed Properties
 WIN 62,577

Molecular Weight:

437.6

Molecular Formula:

C29H31N3O

Hydrogen Bond Donor Count:

1

Hydrogen Bond Acceptor Count:

3

Rotatable Bond Count:

1

Heavy Atom Count:

33

Complexity:

921

  Synonyms
 WIN 62,577

WIN 62,577 WIN 62,577

WIN 62,577

WIN-62577

138091-43-7

144177-32-2

(1R,3aS,3bR,15aR,15bS,17aS)-1-ethynyl-15a,17a-dimethyl-2,3,3a,3b,4,5,15,15a,15b,16,17,17a-dodecahydro-1H-benzo4,5imidazo2,1-bcyclopenta5,6naphtho1,2-gquinazolin-1-ol

(3R,4S,7S,8R,11S,12R)-8-Ethynyl-3,7-dimethyl-18,20,27-triazaheptacyclo15.11.0.03,15.04,12.07,11.019,27.021,26octacosa-1(28),15,17,19,21,23,25-heptaen-8-ol

WIN62,577

WIN 62,577, solid

GTPL340

MLS002153154

win-62,577

CHEMBL1256845

DTXSID50568483

HMS2234A21

MFCD00153883

ZINC13448419

Win 62,577 novel non-peptide nk-

SMR001230649

Q27089225

  Experimental Data
 WIN 62,577

Species Dosage Unit CG Lifespan(AVG/MED days) TG Lifespan(AVG/MED days) Lifespan Change(AVG/MED%) CG Lifespan(MAX days) TG Lifespan(MAX days) Lifespan Change(MAX%) Significant Strain Gender PubMed Active Label
Caenorhabditis elegans 33 umol/L 7 NS N2 24134630 Inactive
  Experimental Data Visualization
 WIN 62,577

  Statistics Data
 WIN 62,577

Species Lifespan Change(AVG/MED%) Lifespan Change(MAX%) Count Reference Count Data point
Caenorhabditis elegans 7 1 1
  Statistics Data Visualization
 WIN 62,577