Spergualin

CAS Registry Number®

80902-43-8
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CAS Name

Spergualin

Molecular Formula

C17H37N7O4

Molecular Mass

403.52

Cite this Page

Spergualin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=80902-43-8 (retrieved 2024-05-18) (CAS RN: 80902-43-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H37N7O4/c18-7-5-9-21-8-3-4-10-22-15(27)16(28)24-14(26)12-13(25)6-1-2-11-23-17(19)20/h13,16,21,25,28H,1-12,18H2,(H,22,27)(H,24,26)(H4,19,20,23)/t13-,16-/m0/s1

InChIKey

InChIKey=GDVNLLJNADMLLR-BBRMVZONSA-N

SMILES

N([C@H](C(NCCCCNCCCN)=O)O)C(C[C@H](CCCCNC(=N)N)O)=O

Canonical SMILES

O=C(NC(O)C(=O)NCCCCNCCCN)CC(O)CCCCNC(=N)N

Other Names for this Substance

  • Heptanamide, 7-[(aminoiminomethyl)amino]-N-[(1S)-2-[[4-[(3-aminopropyl)amino]butyl]amino]-1-hydroxy-2-oxoethyl]-3-hydroxy-, (3S)-
  • Heptanamide, 7-[(aminoiminomethyl)amino]-N-[2-[[4-[(3-aminopropyl)amino]butyl]amino]-1-hydroxy-2-oxoethyl]-3-hydroxy-, [S-(R*,R*)]-
  • (3S)-7-[(Aminoiminomethyl)amino]-N-[(1S)-2-[[4-[(3-aminopropyl)amino]butyl]amino]-1-hydroxy-2-oxoethyl]-3-hydroxyheptanamide
  • Spergualin
  • Antibiotic BMG 162aF2

Deleted or Replaced CAS Registry Numbers

82637-50-1

CAS INSIGHTSTM
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