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(4S)-2,3-dehydroleucocyanidin

MNXM983 is deprecated and here replaced by MNXM1370059
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1370059 Image of MNXM1370059
referencechebi:138948
formulaC15H11O7
global charge-1
mol weight303.246
InChIKeyYAAGNRWEJSZFLV-ZDUSSCGKSA-M
InChIInChI=1S/C15H12O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,13,16-21H/p-1/t13-/m0/s1
SMILES[O-]C1=C(C2=CC(O)=C(O)C=C2)OC2=CC(O)=CC(O)=C2[C@@H]1O
MNX internals
InChI (mnx)InChI=1/C15H12O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,13,16-21H/t13-/m0/s1 Image of MNXM1370059
SMILES (mnx)[CH:1]1=[CH:2][C:8]([OH:17])=[C:9]([OH:18])[CH:3]=[C:6]1[C:15]1=[C:14]([OH:21])[C@@H:13]([OH:20])[C:12]2=[C:10]([OH:19])[CH:4]=[C:7]([OH:16])[CH:5]=[C:11]2[O:22]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:138948
chebi:138948
YAAGNRWEJSZFLV-ZDUSSCGKSA-M 		(4S)-2,3-dehydroleucocyanidin
(4S)-2,3-dehydroleucocyanidin(1-)
(4S)-2-(3,4-dihydroxyphenyl)-4,5,7-trihydroxy-4H-1-benzopyran-3-olate

metacyc.compound:CPD-19726
metacycM:CPD-19726
YAAGNRWEJSZFLV-ZDUSSCGKSA-N 		(4S)-2,3-dehydro-leucocyanidin

CHEBI:139471
chebi:139471
YAAGNRWEJSZFLV-ZDUSSCGKSA-N 		(4S)-2,3-dehydroleucocyanidin
(4S)-2-(3,4-dihydroxyphenyl)-4H-1-benzopyran-3,4,5,7-tetrol