Compound Summary


  Compound Information
 [(2~{S})-2-azanyl-3-oxidanylidene-propyl] (~{Z})-hexadec-9-enoate

Compound Name:

[(2~{S})-2-azanyl-3-oxidanylidene-propyl] (~{Z})-hexadec-9-enoate

Compound CID:

146680867

Synonyms:

(2~{S})-2-azanyl-3-oxidanylidene-propyl (~{Z})-hexadec-9-enoate

O18







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Iupac Name:

[(2S)-2-amino-3-oxopropyl] (Z)-hexadec-9-enoate

InChI:

InChI=1S/C19H35NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(22)23-17-18(20)16-21/h7-8,16,18H,2-6,9-15,17,20H2,1H3/b8-7-/t18-/m1/s1

InChIKey:

BUNQZTJOMDSTRU-JTHGQSKGSA-N

Canonical Smiles:

CCCCCCC=CCCCCCCCC(=O)OCC(C=O)N

Isomeric Smiles:

CCCCCC/C=C\CCCCCCCC(=O)OC[C@@H](C=O)N

Molecular Weight:

325.5

Molecular Formula:

C19H35NO3

  Compound Structure
 2D Structure:
 3D Structure:
  Computed Properties
 [(2~{S})-2-azanyl-3-oxidanylidene-propyl] (~{Z})-hexadec-9-enoate

Molecular Weight:

325.5

Molecular Formula:

C19H35NO3

Hydrogen Bond Donor Count:

1

Hydrogen Bond Acceptor Count:

4

Rotatable Bond Count:

17

Heavy Atom Count:

23

Complexity:

316

  Synonyms
 [(2~{S})-2-azanyl-3-oxidanylidene-propyl] (~{Z})-hexadec-9-enoate

[(2~{S})-2-azanyl-3-oxidanylidene-propyl] (~{Z})-hexadec-9-enoate [(2~{S})-2-azanyl-3-oxidanylidene-propyl] (~{Z})-hexadec-9-enoate

(2~{S})-2-azanyl-3-oxidanylidene-propyl (~{Z})-hexadec-9-enoate

O18

  Experimental Data
 [(2~{S})-2-azanyl-3-oxidanylidene-propyl] (~{Z})-hexadec-9-enoate

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 60 umol/L 21.2 25.8 22.1 S N2 31879284 Active
  Experimental Data Visualization
 [(2~{S})-2-azanyl-3-oxidanylidene-propyl] (~{Z})-hexadec-9-enoate

  Statistics Data
 [(2~{S})-2-azanyl-3-oxidanylidene-propyl] (~{Z})-hexadec-9-enoate

Species Lifespan Change(AVG/MED%) Lifespan Change(MAX%) Count Reference Count Data point
Caenorhabditis elegans 22.1 1 1
  Statistics Data Visualization
 [(2~{S})-2-azanyl-3-oxidanylidene-propyl] (~{Z})-hexadec-9-enoate