记录说明
methyl (2~{R})-1-[2-[methyl-[2-[[(2~{S},3~{S})-3-methyl-2-[methyl-[(2~{R})-3-methyl-2-[methyl-[2-[[2-[methyl-[(2~{S})-1-(2-methylhexanoyl)pyrrolidine-2-carbonyl]amino]-3-phenyl-pro 收自 NPASS。关联生物包括 Symploca laeteviridis。
C55H82N8O10
式量由分子式和标准同位素质量计算,1014.615391。
methyl (2~{R})-1-[2-[methyl-[2-[[(2~{S},3~{S})-3-methyl-2-[methyl-[(2~{R})-3-methyl-2-[methyl-[2-[[2-[methyl-[(2~{S})-1-(2-methylhexanoyl)pyrrolidine-2-carbonyl]amino]-3-phenyl-pro 收自 NPASS。关联生物包括 Symploca laeteviridis。
学名照录来源库原文,不是重新做的分类鉴定。
SMILES
CCCCC(C)C(=O)N1CCC[C@H]1C(=O)N(C)C(CC1=CC=CC=C1)C(=O)NCC(=O)N(C)[C@@H](C(=O)N(C)[C@H](C(=O)NCC(=O)N(C)C(CC1=CC=CC=C1)C(=O)N1CCC[C@@H]1C(=O)OC)[C@@H](C)CC)C(C)C
InChIKey
MDINNDVQINLXEQ-VAWGJASISA-N
CAS:这里用的两张来源表里没有。
IUPAC
methyl (2~{R})-1-[2-[methyl-[2-[[(2~{S},3~{S})-3-methyl-2-[methyl-[(2~{R})-3-methyl-2-[methyl-[2-[[2-[methyl-[(2~{S})-1-(2-methylhexanoyl)pyrrolidine-2-carbonyl]amino]-3-phenyl-propanoyl]amino]acetyl]amino]butanoyl]amino]pentanoyl]amino]acetyl]amino]-3-phenyl-propanoyl]pyrrolidine-2-carboxylate