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ascorbigen

MNXM102854 is deprecated and here replaced by MNXM726115
!!! Alternative mappings exist !!!

Properties

Image

Occurences in reactions

MNX_ID

MNXM726115

	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	0

formula

C₁₅H₁₅NO₆

charge

mass

305.08994

reference

InChIKey

OMSJCIOTCFHSIT-KNUOEEMSSA-N

InChI

InChI=1S/C15H15NO6/c17-11-7-21-15(20)12(11)22-13(18)14(15,19)5-8-6-16-10-4-2-1-3-9(8)10/h1-4,6,11-12,16-17,19-20H,5,7H2/t11-,12+,14?,15-/m0/s1

SMILES

O=C1O[C@@H]2[C@@H](O)CO[C@]2(O)C1(O)Cc1c[nH]c2ccccc12

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:64944 chebi:64944	ascorbigen (3aS,6S,6aR)-3,3a,6-trihydroxy-3-(1H-indol-3-ylmethyl)tetrahydrofuro[3,2-b]furan-2(3H)-one indol-3-ylmethyl-ascorbate
metacyc.compound:CPDQT-426 metacycM:CPDQT-426 seed.compound:cpd26648 seedM:cpd26648	ascorbigen indol-3-ylmethyl-ascorbate
seedM:M_cpd26648	secondary/obsolete/fantasy identifier