PCIDB

KNApSAcK Metabolite C00040348

Metabolite

KNApSAcK Entry

id C00040348
Name Spirastrellolide A
CAS RN 539842-48-3
Standard InChI InChI=1S/C52H81ClO17/c1-30-18-21-50-23-20-40(62-4)48(69-50)47(59)46(58)31(2)16-17-39-45(53)43(63-5)28-51(66-39)22-19-32(3)52(70-51)29-42(38(68-52)15-10-8-6-7-9-14-37(56)49(60)61)65-44(57)27-36-13-11-12-35(64-36)25-33(54)24-34(55)26-41(30)67-50/h7-10,18,21,30-43,45-48,54-56,58-59H,6,11-17,19-20,22-29H2,1-5H3,(H,60,61)/b9-7-,10-8+/t30-,31-,32-,33-,34-,35-,36+,37+,38-,39+,40-,41+,42-,43+,45+,46-,47-,48-,50-,51+,52+/m0/s1
Standard InChI (Main Layer) InChI=1S/C52H81ClO17/c1-30-18-21-50-23-20-40(62-4)48(69-50)47(59)46(58)31(2)16-17-39-45(53)43(63-5)28-51(66-39)22-19-32(3)52(70-51)29-42(38(68-52)15-10-8-6-7-9-14-37(56)49(60)61)65-44(57)27-36-13-11-12-35(64-36)25-33(54)24-34(55)26-41(30)67-50/h7-10,18,21,30-43,45-48,54-56,58-59H,6,11-17,19-20,22-29H2,1-5H3,(H,60,61)

Cluster

Phytochemical cluster
KCF-S cluster No. 5896

Link

ChEMBL

By standard InChI CHEMBL2063006
By standard InChI Main Layer CHEMBL2063006

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count

Family

family name count
Spirastrellidae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Spirastrella coccinea 666328 Spirastrellidae Metazoa