KNApSAcK Metabolite C00035326
Metabolite
KNApSAcK Entry
| id | C00035326 |
|---|---|
| Name | Hirtellin B |
| CAS RN | 135404-48-7 |
| Standard InChI | InChI=1S/C82H56O52/c83-26-1-16(2-27(84)47(26)95)71(112)129-67-65-39(14-122-74(115)19-7-32(89)50(98)57(105)41(19)43-21(76(117)127-65)9-34(91)52(100)59(43)107)125-81(133-73(114)18-5-30(87)49(97)31(88)6-18)69(67)132-80(121)25-12-37(94)55(103)63(111)64(25)124-38-13-24-46(62(110)56(38)104)45-23(11-36(93)54(102)61(45)109)79(120)134-82-70(131-78(24)119)68(130-72(113)17-3-28(85)48(96)29(86)4-17)66-40(126-82)15-123-75(116)20-8-33(90)51(99)58(106)42(20)44-22(77(118)128-66)10-35(92)53(101)60(44)108/h1-13,39-40,65-70,81-111H,14-15H2 |
| Standard InChI (Main Layer) | InChI=1S/C82H56O52/c83-26-1-16(2-27(84)47(26)95)71(112)129-67-65-39(14-122-74(115)19-7-32(89)50(98)57(105)41(19)43-21(76(117)127-65)9-34(91)52(100)59(43)107)125-81(133-73(114)18-5-30(87)49(97)31(88)6-18)69(67)132-80(121)25-12-37(94)55(103)63(111)64(25)124-38-13-24-46(62(110)56(38)104)45-23(11-36(93)54(102)61(45)109)79(120)134-82-70(131-78(24)119)68(130-72(113)17-3-28(85)48(96)29(86)4-17)66-40(126-82)15-123-75(116)20-8-33(90)51(99)58(106)42(20)44-22(77(118)128-66)10-35(92)53(101)60(44)108/h1-13,39-40,65-70,81-111H,14-15H2 |
Cluster
| Phytochemical cluster | No. 81 |
|---|---|
| KCF-S cluster | No. 126 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| eudicotyledons | 1 |
Family
| family name | count |
|---|---|
| Tamaricaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Reaumuria hirtella | 194566 | Tamaricaceae | eudicotyledons | Viridiplantae |