Blasticidin S

CAS Registry Number®

2079-00-7

CAS Name

Blasticidin S

Molecular Formula

C17H26N8O5

Molecular Mass

422.44

Cite this Page

Blasticidin S.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2079-00-7 (retrieved 2024-11-21) (CAS RN: 2079-00-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    235-236 °C (decomp)

Source(s)

  • (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)

Other Names and Identifiers

InChI

InChI=1S/C17H26N8O5/c1-24(16(20)21)6-4-9(18)8-12(26)22-10-2-3-13(30-14(10)15(27)28)25-7-5-11(19)23-17(25)29/h2-3,5,7,9-10,13-14H,4,6,8,18H2,1H3,(H3,20,21)(H,22,26)(H,27,28)(H2,19,23,29)/t9-,10-,13+,14-/m0/s1

InChIKey

InChIKey=CXNPLSGKWMLZPZ-ZNIXKSQXSA-N

SMILES

O=C1N([C@@H]2O[C@H](C(O)=O)[C@@H](NC(C[C@H](CCN(C(=N)N)C)N)=O)C=C2)C=CC(N)=N1

Canonical SMILES

O=C1N=C(N)C=CN1C2OC(C(=O)O)C(C=C2)NC(=O)CC(N)CCN(C(=N)N)C

Other Names for this Substance

  • β-D-erythro-Hex-2-enopyranuronic acid, 4-[[(3S)-3-amino-5-[(aminoiminomethyl)methylamino]-1-oxopentyl]amino]-1-(4-amino-2-oxo-1(2H)-pyrimidinyl)-1,2,3,4-tetradeoxy-
  • Blasticidin S
  • D-erythro-Hex-2-enopyranuronic acid, 4-[3-amino-5-(1-methylguanidino)valeramido]-1-(4-amino-2-oxo-1(2H)-pyrimidinyl)-1,2,3,4-tetradeoxy-
  • 4-[[(3S)-3-Amino-5-[(aminoiminomethyl)methylamino]-1-oxopentyl]amino]-1-(4-amino-2-oxo-1(2H)-pyrimidinyl)-1,2,3,4-tetradeoxy-β-D-erythro-hex-2-enopyranuronic acid
  • Bla-S

View All

Deleted or Replaced CAS Registry Numbers

7562-21-2, 11002-92-9, 11028-10-7, 12767-55-4, 13184-51-5, 885262-44-2, 1135442-94-2

CAS INSIGHTSTM
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