Chemical Compound

HEALDAASUSTTPJ-QGTLAHJGSA-N

CAS Registry Number 113662-54-7
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HEALDAASUSTTPJ-QGTLAHJGSA-N chemical structure
Primary Record

HEALDAASUSTTPJ-QGTLAHJGSA-N

In stock
9,028 g
Purity
98.1 %
CAS
113662-54-7

Compound Identifiers & Properties

CAS
113662-54-7
PubChem CID
170852214
SMILES
CC[C@H](C)[C@@H](C(=N[C@@H](CC(=N)O)C(=N[C@@H](CC(C)C)C(=N[C@@H]([C@@H](C)CC)C(=N[C@@H]([C@@H](C)O)C(=N[C@@H](CCCNC(=N)N)C(=N[C@@H](CCC(=N)O)C(=N[C@@H](CCCNC(=N)N)C(=N[C@@H](CC1=CC=C(C=C1)O)C(=N)O)O)O)O)O)O)O)O)O)N=C([C@H](CC2=CC=C(C=C2)O)N=C([C@H](CC3=CN=CN3)N=C([C@H](CCCNC(=N)N)N=C([C@H](CC(C)C)N=C([C@H](C)N=C([C@H](CO)N=C([C@H](CC4=CC=C(C=C4)O)N=C([C@H](CC5=CC=C(C=C5)O)N=C([C@H](CCCNC(=N)N)N=C([C@H](C)N=C([C@H](CC(C)C)N=C([C@H](CC(=O)O)N=C([C@H](CCC(=O)O)N=C([C@H](C)N=C([C@@H]6CCCN6)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O
Canonical SMILES
CC[C@H](C)[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](Cc1cnc[nH]1)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CC(C)C)N=C(O)[C@H](C)N=C(O)[C@H](CO)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](C)N=C(O)[C@H](CC(C)C)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](C)N=C(O)[C@@H]1CCCN1)C(O)=N[C@@H](CC(=N)O)C(O)=N[C@@H](CC(C)C)C(O)=N[C@H](C(O)=N[C@H](C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](Cc1ccc(O)cc1)C(=N)O)[C@@H](C)O)[C@@H](C)CC

Names & Synonyms

  • HEALDAASUSTTPJ-QGTLAHJGSA-N
  • MFCD00133666
  • C135H209N41O36
  • (4S)-5-[[(1S)-2-[[(1S)-1-[[(1S)-2-[[(1S)-1-[[(1S)-2-[[(1S)-2-[[(1S)-2-[[(1S)-2-[[(1S)-1-[[(1S)-1-[[(1S)-2-[[(1S)-2-[[(1S,2S)-1-[[(1S)-3-amino-1-[[(1S)-1-[[(1S,2S)-1-[[(1S,2R)-1-[[(1S)-1-[[(1S)-4-amino-1-[[(1S)-1-[[(1S)-2-amino-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]carbamoyl]-4-guanidino-butyl]carbamoyl]-4-oxo-butyl]carbamoyl]-4-guanidino-butyl]carbamoyl]-2-hydroxy-propyl]carbamoyl]-2-methyl-butyl]carbamoyl]-3-methyl-butyl]carbamoyl]-3-oxo-propyl]carbamoyl]-2-methyl-butyl]amino]-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]amino]-1-(1H-imidazol-5-ylmethyl)-2-oxo-ethyl]carbamoyl]-4-guanidino-butyl]carbamoyl]-3-methyl-butyl]amino]-1-methyl-2-oxo-ethyl]amino]-1-(hydroxymethyl)-2-oxo-ethyl]amino]-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]amino]-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]carbamoyl]-4-guanidino-butyl]amino]-1-methyl-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]amino]-1-(carboxymethyl)-2-oxo-e
  • 113662-54-7