PCIDB

KNApSAcK Metabolite C00006316

Metabolite

KNApSAcK Entry

id C00006316
Name Isoorientin 3'-O-neohesperidoside
CAS RN 102148-99-2
Standard InChI InChI=1S/C33H40O20/c1-9-21(39)25(43)29(47)32(48-9)53-31-27(45)23(41)18(8-35)52-33(31)51-15-4-10(2-3-11(15)36)14-5-12(37)19-16(49-14)6-13(38)20(24(19)42)30-28(46)26(44)22(40)17(7-34)50-30/h2-6,9,17-18,21-23,25-36,38-47H,7-8H2,1H3/t9?,17?,18?,21-,22+,23+,25-,26-,27-,28?,29?,30-,31?,32-,33+/m0/s1
Standard InChI (Main Layer) InChI=1S/C33H40O20/c1-9-21(39)25(43)29(47)32(48-9)53-31-27(45)23(41)18(8-35)52-33(31)51-15-4-10(2-3-11(15)36)14-5-12(37)19-16(49-14)6-13(38)20(24(19)42)30-28(46)26(44)22(40)17(7-34)50-30/h2-6,9,17-18,21-23,25-36,38-47H,7-8H2,1H3

Cluster

Phytochemical cluster No. 15
KCF-S cluster No. 5

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
Embryophyta 1

Family

family name count
Mniaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Plagiomnium affine 66997 Mniaceae Embryophyta Viridiplantae