Photobiotin

CAS Registry Number®

96087-37-5

CAS Name

Photobiotin

Molecular Formula

C23H35N9O4S

Cite this Page

Photobiotin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=96087-37-5 (retrieved 2024-12-23) (CAS RN: 96087-37-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C23H35N9O4S/c1-31(12-4-10-25-17-9-8-16(29-30-24)14-19(17)32(35)36)13-5-11-26-21(33)7-3-2-6-20-22-18(15-37-20)27-23(34)28-22/h8-9,14,18,20,22,25H,2-7,10-13,15H2,1H3,(H,26,33)(H2,27,28,34)/t18-,20-,22-/m0/s1

InChIKey

InChIKey=BRLRJZRHRJEWJY-VCOUNFBDSA-N

SMILES

C(CCCC(NCCCN(CCCNC1=C(N(=O)=O)C=C(N=[N+]=[N-])C=C1)C)=O)[C@H]2[C@@]3([C@](CS2)(NC(=O)N3)[H])[H]

Canonical SMILES

[N-]=[N+]=NC1=CC=C(NCCCN(C)CCCNC(=O)CCCCC2SCC3NC(=O)NC23)C(=C1)N(=O)=O

Other Names for this Substance

  • 1H-Thieno[3,4-d]imidazole-4-pentanamide, N-[3-[[3-[(4-azido-2-nitrophenyl)amino]propyl]methylamino]propyl]hexahydro-2-oxo-, (3aS,4S,6aR)-
  • 1H-Thieno[3,4-d]imidazole-4-pentanamide, N-[3-[[3-[(4-azido-2-nitrophenyl)amino]propyl]methylamino]propyl]hexahydro-2-oxo-, [3aS-(3aα,4β,6aα)]-
  • (3aS,4S,6aR)-N-[3-[[3-[(4-Azido-2-nitrophenyl)amino]propyl]methylamino]propyl]hexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-pentanamide
  • Photobiotin
  • EZ-Link Photoactivatable Biotin

CAS INSIGHTSTM
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