Trimannosyldilysine
HIT214320341
sdf文件结构编辑类似物检索
HIT ID: HIT214320341
Cas No: 79390-81-1
分子式: C39H68N4O21S3
分子量: 1025.16
常用名: Trimannosyldilysine
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 2-[2,6-bis(3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}propanamido)hexanamido]-6-(3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}propanamido)hexanoic acid
IUPAC: 2-[2,6-bis(3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}propanamido)hexanamido]-6-(3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}propanamido)hexanoic acid
SMILES: OCC1OC(SCCC(=O)NCCCCC(NC(=O)C(CCCCNC(=O)CCSC2OC(CO)C(O)C(O)C2O)NC(=O)CCSC2OC(CO)C(O)C(O)C2O)C(O)=O)C(O)C(O)C1O
SMILES: OCC1OC(SCCC(=O)NCCCCC(NC(=O)C(CCCCNC(=O)CCSC2OC(CO)C(O)C(O)C2O)NC(=O)CCSC2OC(CO)C(O)C(O)C2O)C(O)=O)C(O)C(O)C1O
InChI key: XNLMOLQNXJIGDH-UHFFFAOYSA-N
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