PCIDB

KNApSAcK Metabolite C00040420

Metabolite

KNApSAcK Entry

id C00040420
Name Swinholide B
CAS RN 132943-68-1
Standard InChI InChI=1S/C77H130O20/c1-45-22-28-56(78)36-59-18-16-20-61(94-59)40-67(90-14)38-58(80)39-68(81)52(8)76(54(10)74(86)47(3)26-30-63-41-65(88-12)34-49(5)92-63)96-72(84)32-24-46(2)23-29-57(79)37-60-19-17-21-62(95-60)43-71(91-15)51(7)69(82)44-70(83)53(9)77(97-73(85)33-25-45)55(11)75(87)48(4)27-31-64-42-66(89-13)35-50(6)93-64/h16-17,20-25,32-33,47-71,74-83,86-87H,18-19,26-31,34-44H2,1-15H3/b32-24-,33-25-,45-22-,46-23-
Standard InChI (Main Layer) InChI=1S/C77H130O20/c1-45-22-28-56(78)36-59-18-16-20-61(94-59)40-67(90-14)38-58(80)39-68(81)52(8)76(54(10)74(86)47(3)26-30-63-41-65(88-12)34-49(5)92-63)96-72(84)32-24-46(2)23-29-57(79)37-60-19-17-21-62(95-60)43-71(91-15)51(7)69(82)44-70(83)53(9)77(97-73(85)33-25-45)55(11)75(87)48(4)27-31-64-42-66(89-13)35-50(6)93-64/h16-17,20-25,32-33,47-71,74-83,86-87H,18-19,26-31,34-44H2,1-15H3

Cluster

Phytochemical cluster
KCF-S cluster No. 888

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN C068192

Species

Summary

Plant class

class name count

Family

family name count
Theonellidae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Theonella swinhoei 37505 Theonellidae Metazoa