HIT ID: HIT219152521
Cas No:
分子式: C30H43N3O10
分子量: 605.685
常用名: NOD2 agonist 1
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 1,5-diethyl (2R)-2-[(2S)-2-{2-[(2E)-3-[4-(butanoyloxy)-3-methoxyphenyl]prop-2-enamido]acetamido}-3-methylbutanamido]pentanedioate
IUPAC: 1,5-diethyl (2R)-2-[(2S)-2-{2-[(2E)-3-[4-(butanoyloxy)-3-methoxyphenyl]prop-2-enamido]acetamido}-3-methylbutanamido]pentanedioate
SMILES: CCCC(=O)Oc1ccc(\C=C\C(=O)NCC(=O)N[C@@H](C(C)C)C(=O)N[C@H](CCC(=O)OCC)C(=O)OCC)cc1OC
SMILES: CCCC(=O)Oc1ccc(\C=C\C(=O)NCC(=O)N[C@@H](C(C)C)C(=O)N[C@H](CCC(=O)OCC)C(=O)OCC)cc1OC
InChI key: MYLNTBWQFUCRAT-NTDYMLGNSA-N
