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cis-p-Coumaric acid 4-[apiosyl-(1->2)-glucoside]

Properties

Image

Occurences in reactions

MNX_ID

MNXM120609

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₂₀H₂₆O₁₂

charge

mass

458.14243

reference

chebi:167954

InChIKey

DAVWDWCHQLSZAZ-ZZXKWVIFSA-N

InChI

InChI=1S/C20H26O12/c21-7-12-14(25)15(26)16(32-19-17(27)20(28,8-22)9-29-19)18(31-12)30-11-4-1-10(2-5-11)3-6-13(23)24/h1-6,12,14-19,21-22,25-28H,7-9H2,(H,23,24)/b6-3+

SMILES

O=C(O)/C=C/c1ccc(OC2OC(CO)C(O)C(O)C2OC2OCC(O)(CO)C2O)cc1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:167954 chebi:167954	cis-p-Coumaric acid 4-[apiosyl-(1->2)-glucoside] (E)-3-[4-[3-[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoic acid
hmdb:HMDB0037088	cis-p-Coumaric acid 4-[apiosyl-(1->2)-glucoside] (2E)-3-{4-[(3-{[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]phenyl}prop-2-enoate (2E)-3-{4-[(3-{[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]phenyl}prop-2-enoic acid cis-p-Coumarate 4-[apiosyl-(1->2)-glucoside]
hmdb:HMDB37088	secondary/obsolete/fantasy identifier