PCIDB

KNApSAcK Metabolite C00024875

Metabolite

KNApSAcK Entry

id C00024875
Name Delgrandine / (-)-Delgrandine
CAS RN 14537-05-4
Standard InChI InChI=1S/C41H43NO12/c1-19-17-40-26-28(53-37(48)23-13-9-7-10-14-23)25(19)29(50-20(2)44)32(40)41-31(27(34(40)47)42(6)33(26)41)39(5,18-43)35(51-21(3)45)30(36(41)52-22(4)46)54-38(49)24-15-11-8-12-16-24/h7-16,18,25-36,47H,1,17H2,2-6H3/t25-,26+,27+,28?,29+,30-,31+,32+,33?,34+,35-,36+,39-,40?,41?/m0/s1
Standard InChI (Main Layer) InChI=1S/C41H43NO12/c1-19-17-40-26-28(53-37(48)23-13-9-7-10-14-23)25(19)29(50-20(2)44)32(40)41-31(27(34(40)47)42(6)33(26)41)39(5,18-43)35(51-21(3)45)30(36(41)52-22(4)46)54-38(49)24-15-11-8-12-16-24/h7-16,18,25-36,47H,1,17H2,2-6H3

Cluster

Phytochemical cluster
KCF-S cluster No. 1192

Link

ChEMBL

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By standard InChI Main Layer

KEGG

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CTD

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