Chemical Compound
(1S,5S,6R,13R,21S)-5,13-bis(3,4-dihydroxyphenyl)-16-[(1S,5S,6R,7S,13R,21R)-6,9,17,19,21-pentahydroxy-5,13-bis(4-hydroxyphenyl)-4,12,14-trioxapentacyclo[11.7.1.02,11.03,8.015,20]henicosa-2(11),3(8),9,15,17,19-hexaen-7-yl]-4,12,14-trioxapentacyclo[11.7.1.02,11.03,8.015,20]henicosa-2,8,10,15,17,19-hexaene-6,9,17,19,21-pentol
Primary record
(1S,5S,6R,13R,21S)-5,13-bis(3,4-dihydroxyphenyl)-16-[(1S,5S,6R,7S,13R,21R)-6,9,17,19,21-pentahydroxy-5,13-bis(4-hydroxyphenyl)-4,12,14-trioxapentacyclo[11.7.1.02,11.03,8.015,20]henicosa-2(11),3(8),9,15,17,19-hexaen-7-yl]-4,12,14-trioxapentacyclo[11.7.1.02,11.03,8.015,20]henicosa-2,8,10,15,17,19-hexaene-6,9,17,19,21-pentol
- 库存
- 550 克
- 纯度
- 98.1 %
化合物标识与属性
- PubChem CID
- 101683695
- SMILES
- C1[C@H]([C@@H](OC2=C1C(=CC3=C2[C@H]4[C@@H]([C@](O3)(OC5=C(C(=CC(=C45)O)O)[C@H]6[C@H]([C@@H](OC7=C6C(=CC8=C7[C@H]9[C@H]([C@@](O8)(OC1=CC(=CC(=C91)O)O)C1=CC=C(C=C1)O)O)O)C1=CC=C(C=C1)O)O)C1=CC(=C(C=C1)O)O)O)O)C1=CC(=C(C=C1)O)O)O
- Canonical SMILES
- Oc1ccc([C@@H]2Oc3c(c(O)cc4c3[C@@H]3c5c(O)cc(O)cc5O[C@](c5ccc(O)cc5)(O4)[C@@H]3O)[C@@H](c3c(O)cc(O)c4c3O[C@@]3(c5ccc(O)c(O)c5)Oc5cc(O)c6c(c5[C@H]4[C@@H]3O)O[C@@H](c3ccc(O)c(O)c3)[C@H](O)C6)[C@H]2O)cc1
名称与同义词
- Pavetannin C4
- J691.732A
- (1S,5S,6R,13R,21S)-5,13-bis(3,4-dihydroxyphenyl)-16-[(1S,5S,6R,7S,13R,21R)-6,9,17,19,21-pentahydroxy-5,13-bis(4-hydroxyphenyl)-4,12,14-trioxapentacyclo[11.7.1.02,11.03,8.015,20]henicosa-2(11),3(8),9,15,17,19-hexaen-7-yl]-4,12,14-trioxapentacyclo[11.7.1.02,11.03,8.015,20]henicosa-2,8,10,15,17,19-hexaene-6,9,17,19,21-pentol
- (2S,2 S,15R,15 S)-2beta,8beta-Bis(4-hydroxyphenyl)-2 beta,8 alpha-bis(3,4-dihydroxyphenyl)-3,3 ,4,4 -tetrahydro-8,14alpha:8 ,14 alpha-bismethano-4alpha,10 -bi[2H,14H-1-benzopyrano[7,8-d][1,3]benzodioxocin]-3alpha,3 alpha,5,5 ,11,11 ,13,13 ,15,15 -decol