PCIDB

KNApSAcK Metabolite C00009370

Metabolite

KNApSAcK Entry

id C00009370
Name Mongolicin A
CAS RN 118964-13-9
Standard InChI InChI=1S/C62H46O37/c63-8-21-38(74)47(83)50(86)62(94-21)99-55-46(82)27-17(67)7-16(66)26(53(27)95-51(55)10-1-2-14(64)15(65)3-10)32-31-34-30(44(80)49(85)45(31)81)29-33-28(42(78)48(84)43(29)79)25-13(6-20(70)37(73)41(25)77)58(88)93-22-9-92-57(87)11-4-18(68)35(71)39(75)23(11)24-12(5-19(69)36(72)40(24)76)59(89)96-52(22)56(98-61(33)91)54(32)97-60(34)90/h1-7,21-22,32,38,47,50-52,54-56,62-81,83-86H,8-9H2/t21?,22-,32+,38-,47+,50?,51-,52-,54+,55+,56+,62+/m1/s1
Standard InChI (Main Layer) InChI=1S/C62H46O37/c63-8-21-38(74)47(83)50(86)62(94-21)99-55-46(82)27-17(67)7-16(66)26(53(27)95-51(55)10-1-2-14(64)15(65)3-10)32-31-34-30(44(80)49(85)45(31)81)29-33-28(42(78)48(84)43(29)79)25-13(6-20(70)37(73)41(25)77)58(88)93-22-9-92-57(87)11-4-18(68)35(71)39(75)23(11)24-12(5-19(69)36(72)40(24)76)59(89)96-52(22)56(98-61(33)91)54(32)97-60(34)90/h1-7,21-22,32,38,47,50-52,54-56,62-81,83-86H,8-9H2

Cluster

Phytochemical cluster
KCF-S cluster No. 142

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 1

Family

family name count
Fagaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Quercus mongolica 103485 Fagaceae rosids Viridiplantae