PCIDB

KNApSAcK Metabolite C00039022

Metabolite

KNApSAcK Entry

id C00039022
Name Didemnaketal B
CAS RN 135257-48-6
Standard InChI InChI=1S/C52H86O15/c1-16-33(7)50(58)64-42(48(62-39(13)53)38(12)40(63-44(54)18-3)23-22-36(10)49(57)61-15)27-37(11)47(65-51(59)34(8)17-2)43-25-32(6)29-52(67-43)28-31(5)24-41(66-52)46(56)35(9)21-19-20-30(4)26-45(55)60-14/h21-22,30-34,37-38,40-43,46-48,56H,16-20,23-29H2,1-15H3/b35-21+,36-22+/t30-,31+,32-,33?,34?,37-,38-,40-,41-,42+,43-,46-,47-,48+,52-/m0/s1
Standard InChI (Main Layer) InChI=1S/C52H86O15/c1-16-33(7)50(58)64-42(48(62-39(13)53)38(12)40(63-44(54)18-3)23-22-36(10)49(57)61-15)27-37(11)47(65-51(59)34(8)17-2)43-25-32(6)29-52(67-43)28-31(5)24-41(66-52)46(56)35(9)21-19-20-30(4)26-45(55)60-14/h21-22,30-34,37-38,40-43,46-48,56H,16-20,23-29H2,1-15H3

Cluster

Phytochemical cluster
KCF-S cluster No. 4379

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count

Family

family name count
Didemnidae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Didemnum sp. 107395 Didemnidae Metazoa