PCIDB

KNApSAcK Metabolite C00025080

Metabolite

KNApSAcK Entry

id C00025080
Name Insulopinine
CAS RN 102965-05-9
Standard InChI InChI=1S/C40H46N4O2/c1-3-37-13-6-18-42-20-12-27-26-8-4-5-9-31(26)44(33(27)34(37)42)32(24-37)25-10-11-30-28(22-25)39-17-21-43-19-7-14-38(36(39)43)15-16-40(39,41-30)29(23-38)35(45)46-2/h4-6,8-11,13,22,29,32,34,36,41H,3,7,12,14-21,23-24H2,1-2H3/t29-,32-,34-,36+,37+,38-,39?,40-/m1/s1
Standard InChI (Main Layer) InChI=1S/C40H46N4O2/c1-3-37-13-6-18-42-20-12-27-26-8-4-5-9-31(26)44(33(27)34(37)42)32(24-37)25-10-11-30-28(22-25)39-17-21-43-19-7-14-38(36(39)43)15-16-40(39,41-30)29(23-38)35(45)46-2/h4-6,8-11,13,22,29,32,34,36,41H,3,7,12,14-21,23-24H2,1-2H3

Cluster

Phytochemical cluster
KCF-S cluster No. 1015

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Apocynaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Melodinus insulae-pinorum 141584 Apocynaceae asterids Viridiplantae