HIT ID: HIT218658594
Cas No: 35115-60-7
分子式: C53H76N14O12
分子量: 1101.277
常用名: Teprotide
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (2S)-1-[(2S)-1-[(2S,3S)-2-[(2S)-2-{[(2S)-1-[(2S)-5-carbamimidamido-2-{[(2S)-1-[(2S)-3-(1H-indol-3-yl)-2-{[(2S)-5-oxopyrrolidin-2-yl]formamido}propanoyl]pyrrolidin-2-yl]formamido}pentanoyl]pyrrolidin-2-yl]formamido}-4-carbamoylbutanamido]-3-methylpentanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
IUPAC: (2S)-1-[(2S)-1-[(2S,3S)-2-[(2S)-2-{[(2S)-1-[(2S)-5-carbamimidamido-2-{[(2S)-1-[(2S)-3-(1H-indol-3-yl)-2-{[(2S)-5-oxopyrrolidin-2-yl]formamido}propanoyl]pyrrolidin-2-yl]formamido}pentanoyl]pyrrolidin-2-yl]formamido}-4-carbamoylbutanamido]-3-methylpentanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
SMILES: CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(O)=O
SMILES: CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(O)=O
InChI key: UUUHXMGGBIUAPW-CSCXCSGISA-N
