Chemical Compound

(1R,2S,3R,6S)-6-[(1R)-1-carboxyethyl]-2-{2-[15,20-diethenyl-5,9-bis(3-methoxy-3-oxopropyl)-4,10,14,19-tetramethyl-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl]ethyl}-1-hydroxy-3-methylcyclohexane-1-carboxylic acid

(1R,2S,3R,6S)-6-[(1R)-1-carboxyethyl]-2-{2-[15,20-diethenyl-5,9-bis(3-methoxy-3-oxopropyl)-4,10,14,19-tetramethyl-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl]ethyl}-1-hydroxy-3-methylcyclohexane-1-carboxylic acid 结构式
Primary record

(1R,2S,3R,6S)-6-[(1R)-1-carboxyethyl]-2-{2-[15,20-diethenyl-5,9-bis(3-methoxy-3-oxopropyl)-4,10,14,19-tetramethyl-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl]ethyl}-1-hydroxy-3-methylcyclohexane-1-carboxylic acid

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
132472757
SMILES
C[C@@H]1CC[C@H]([C@]([C@H]1CCC2=C3C(=C(C(=N3)C=C4C(=C(C(=CC5=C(C(=C(N5)C=C6C(=C(C2=N6)C=C)C)C=C)C)N4)C)CCC(=O)OC)CCC(=O)OC)C)(C(=O)O)O)[C@@H](C)C(=O)O
Canonical SMILES
C=CC1=C(C)c2cc3[nH]c(cc4[nH]c(cc5nc(c(CC[C@H]6[C@H](C)CC[C@@H]([C@@H](C)C(=O)O)[C@@]6(O)C(=O)O)c1n2)C(C)=C5CCC(=O)OC)c(CCC(=O)OC)c4C)c(C)c3C=C

名称与同义词

  • J1.836.521I
  • (1R,2S,3R,6S)-6-[(1R)-1-carboxyethyl]-2-{2-[15,20-diethenyl-5,9-bis(3-methoxy-3-oxopropyl)-4,10,14,19-tetramethyl-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl]ethyl}-1-hydroxy-3-methylcyclohexane-1-carboxylic acid
  • 10-[2-[(1S)-2beta-Hydroxy-2-carboxy-3alpha-[(R)-1-carboxyethyl]-6beta-methylcyclohexan-1alpha-yl]ethyl]protoporphyrin 13,17-dimethyl ester