PCIDB

KNApSAcK Metabolite C00014963

Metabolite

KNApSAcK Entry

id C00014963
Name SNA 60-367-9
CAS RN 193738-72-6
Standard InChI InChI=1S/C74H114N12O20/c1-42(2)19-15-13-11-9-8-10-12-14-16-20-49(89)41-59(91)77-52(32-35-60(92)93)66(97)78-51(21-17-37-75)65(96)81-56-40-47-25-29-50(30-26-47)106-74(105)63(44(5)6)84-69(100)55(39-46-23-27-48(88)28-24-46)82-67(98)53(31-34-58(76)90)79-71(102)57-22-18-38-86(57)73(104)62(43(3)4)83-68(99)54(33-36-61(94)95)80-72(103)64(45(7)87)85-70(56)101/h23-30,42-45,49,51-57,62-64,87-89H,8-22,31-41,75H2,1-7H3,(H2,76,90)(H,77,91)(H,78,97)(H,79,102)(H,80,103)(H,81,96)(H,82,98)(H,83,99)(H,84,100)(H,85,101)(H,92,93)(H,94,95)/t45-,49?,51-,52-,53-,54-,55?,56?,57-,62+,63-,64+/m0/s1
Standard InChI (Main Layer) InChI=1S/C74H114N12O20/c1-42(2)19-15-13-11-9-8-10-12-14-16-20-49(89)41-59(91)77-52(32-35-60(92)93)66(97)78-51(21-17-37-75)65(96)81-56-40-47-25-29-50(30-26-47)106-74(105)63(44(5)6)84-69(100)55(39-46-23-27-48(88)28-24-46)82-67(98)53(31-34-58(76)90)79-71(102)57-22-18-38-86(57)73(104)62(43(3)4)83-68(99)54(33-36-61(94)95)80-72(103)64(45(7)87)85-70(56)101/h23-30,42-45,49,51-57,62-64,87-89H,8-22,31-41,75H2,1-7H3,(H2,76,90)(H,77,91)(H,78,97)(H,79,102)(H,80,103)(H,81,96)(H,82,98)(H,83,99)(H,84,100)(H,85,101)(H,92,93)(H,94,95)

Cluster

Phytochemical cluster
KCF-S cluster No. 501

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
Bacillaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Bacillus sp. SNA-60-367 186817 Bacillaceae Bacteria