Cas no 161212-38-0 (Erinacean)

Erinacean structure
Erinacean structure
Product Name:Erinacean
CAS No:161212-38-0
MF:C8H9N5O3
MW:223.188760519028
CID:185017
Update Time:2024-03-01

Erinacean Chemical and Physical Properties

Names and Identifiers

    • b-Alanine,N-(7,8-dihydro-8-oxo-1H-purin-6-yl)- (9CI)
    • Erinacean
    • RXGSEDHUXCWOJX-UHFFFAOYSA-
    • beta-Alanine, N-(7,8-dihydro-8-oxo-1H-purin-6-yl)- (9CI)
    • Inchi: 1S/C8H9N5O3/c14-4(15)1-2-9-6-5-7(11-3-10-6)13-8(16)12-5/h3H,1-2H2,(H,14,15)(H3,9,10,11,12,13,16)
    • InChI Key: RXGSEDHUXCWOJX-UHFFFAOYSA-N
    • SMILES: O=C1NC2C(=C(N=CN=2)NCCC(=O)O)N1

Computed Properties

  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 297
  • XLogP3: -0.5
  • Topological Polar Surface Area: 116
Recommended suppliers
Nantong Boya Environmental Protection Technology Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Nantong Boya Environmental Protection Technology Co., Ltd
NewCan Biotech Limited
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
NewCan Biotech Limited
Zhejiang Brunova Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Zhejiang Brunova Technology Co., Ltd.
Enjia Trading Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Enjia Trading Co., Ltd
上海嶸奧生物技術(shù)有限公司
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
上海嶸奧生物技術(shù)有限公司