PCIDB

KNApSAcK Metabolite C00016799

Metabolite

KNApSAcK Entry

id C00016799
Name Pradimicin S
CAS RN 146446-02-8
Standard InChI InChI=1S/C41H46N2O22S/c1-11-6-18-24(31(50)21(11)38(54)43-12(2)39(55)56)23-16(9-17-25(32(23)51)28(47)15-7-14(60-5)8-19(45)22(15)27(17)46)29(48)35(18)63-40-33(52)36(26(42-4)13(3)61-40)64-41-34(53)37(65-66(57,58)59)30(49)20(10-44)62-41/h6-9,12-13,20,26,29-30,33-37,40-42,44-45,48-53H,10H2,1-5H3,(H,43,54)(H,55,56)(H,57,58,59)/t12?,13?,20?,26-,29?,30+,33?,34?,35?,36-,37-,40-,41-/m0/s1
Standard InChI (Main Layer) InChI=1S/C41H46N2O22S/c1-11-6-18-24(31(50)21(11)38(54)43-12(2)39(55)56)23-16(9-17-25(32(23)51)28(47)15-7-14(60-5)8-19(45)22(15)27(17)46)29(48)35(18)63-40-33(52)36(26(42-4)13(3)61-40)64-41-34(53)37(65-66(57,58)59)30(49)20(10-44)62-41/h6-9,12-13,20,26,29-30,33-37,40-42,44-45,48-53H,10H2,1-5H3,(H,43,54)(H,55,56)(H,57,58,59)

Cluster

Phytochemical cluster
KCF-S cluster No. 717

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL1673204

KEGG

By LinkDB

CTD

By CAS RN C080896

Species

Summary

Plant class

class name count

Family

family name count
Thermomonosporaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Actinomadura spinosa AA0851 1988 Thermomonosporaceae Bacteria