PCIDB

KNApSAcK Metabolite C00038027

Metabolite

KNApSAcK Entry

id C00038027
Name Yunnaneic acid A
CAS RN 180314-55-0
Standard InChI InChI=1S/C54H46O24/c55-29-7-1-21(13-33(29)59)15-37(49(66)67)75-39(63)11-5-23-18-28-42(25-4-10-32(58)36(62)20-25)44(51(70)71)43(23)47(65)54(28)77-48-27-17-26(6-12-40(64)76-38(50(68)69)16-22-2-8-30(56)34(60)14-22)46(53(48,74)78-54)45(52(72)73)41(27)24-3-9-31(57)35(61)19-24/h1-14,17-20,27-28,37-38,41-46,48,55-62,74H,15-16H2,(H,66,67)(H,68,69)(H,70,71)(H,72,73)/b11-5+,12-6+
Standard InChI (Main Layer) InChI=1S/C54H46O24/c55-29-7-1-21(13-33(29)59)15-37(49(66)67)75-39(63)11-5-23-18-28-42(25-4-10-32(58)36(62)20-25)44(51(70)71)43(23)47(65)54(28)77-48-27-17-26(6-12-40(64)76-38(50(68)69)16-22-2-8-30(56)34(60)14-22)46(53(48,74)78-54)45(52(72)73)41(27)24-3-9-31(57)35(61)19-24/h1-14,17-20,27-28,37-38,41-46,48,55-62,74H,15-16H2,(H,66,67)(H,68,69)(H,70,71)(H,72,73)

Cluster

Phytochemical cluster
KCF-S cluster No. 5613

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
Lamiaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Salvia yunnanensis 342062 Lamiaceae asterids Viridiplantae