24-[2-[4-[[(4E,8S,9S,10E,12S,13R,14S,16R)-9-carbamoyloxy-13,20,22-trihydroxy-8,14-dimethoxy-4,10,12,16-tetramethyl-3-oxo-2-azabicyclo[16.3.1]docosa-1(21),4,6,10,18(22),19-hexaen-19-yl]imino]butylamino]-2-oxoethyl]-5,5,27,27-tetramethyl-16-oxa-20-aza-12-azoniaheptacyclo[15.11.0.03,15.04,12.06,11.020,28.021,26]octacosa-1(28),2,4(12),6(11),7,9,21(26),22,24-nonaene-8-sulfonic acid

分子结构分类

有机化合物 - 苯丙烷和聚酮 - 大环内酰胺类

中文名称

——

中文别名

——

英文名称

24-[2-[4-[[(4E,8S,9S,10E,12S,13R,14S,16R)-9-carbamoyloxy-13,20,22-trihydroxy-8,14-dimethoxy-4,10,12,16-tetramethyl-3-oxo-2-azabicyclo[16.3.1]docosa-1(21),4,6,10,18(22),19-hexaen-19-yl]imino]butylamino]-2-oxoethyl]-5,5,27,27-tetramethyl-16-oxa-20-aza-12-azoniaheptacyclo[15.11.0.03,15.04,12.06,11.020,28.021,26]octacosa-1(28),2,4(12),6(11),7,9,21(26),22,24-nonaene-8-sulfonic acid

英文别名

——

24-[2-[4-[[(4E,8S,9S,10E,12S,13R,14S,16R)-9-carbamoyloxy-13,20,22-trihydroxy-8,14-dimethoxy-4,10,12,16-tetramethyl-3-oxo-2-azabicyclo[16.3.1]docosa-1(21),4,6,10,18(22),19-hexaen-19-yl]imino]butylamino]-2-oxoethyl]-5,5,27,27-tetramethyl-16-oxa-20-aza-12-azoniaheptacyclo[15.11.0.03,15.04,12.06,11.020,28.021,26]octacosa-1(28),2,4(12),6(11),7,9,21(26),22,24-nonaene-8-sulfonic acid化学式

CAS

——

化学式

C63H79N6O13S+

mdl

——

分子量

1160.4

InChiKey

PUYUEPCBDWRZOF-KJIPBKRCSA-O

BEILSTEIN

——

EINECS

——

计算性质

辛醇/水分配系数(LogP)：

5.3
重原子数：

83
可旋转键数：

12
环数：

9.0
sp3杂化的碳原子比例：

0.48
拓扑面积：

280
氢给体数：

7
氢受体数：

15

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分子结构分类

计算性质

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