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Isowertin 2''-rhamnoside

MNXM738849 is deprecated and here replaced by MNXM1370368
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1370368 Image of MNXM1370368
referencechebi:176169
formulaC28H32O14
global charge0
mol weight592.55
InChIKeyHFUYHHROXLKXRR-UHFFFAOYSA-N
InChIInChI=1S/C28H32O14/c1-10-20(33)22(35)24(37)28(39-10)42-27-23(36)21(34)17(9-29)41-26(27)19-16(38-2)8-14(32)18-13(31)7-15(40-25(18)19)11-3-5-12(30)6-4-11/h3-8,10,17,20-24,26-30,32-37H,9H2,1-2H3
SMILESCOC1=CC(O)=C2C(=O)C=C(C3=CC=C(O)C=C3)OC2=C1C1OC(CO)C(O)C(O)C1OC1OC(C)C(O)C(O)C1O
MNX internals
InChI (mnx)InChI=1/C28H32O14/c1-10-20(33)22(35)24(37)28(39-10)42-27-23(36)21(34)17(9-29)41-26(27)19-16(38-2)8-14(32)18-13(31)7-15(40-25(18)19)11-3-5-12(30)6-4-11/h3-8,10,17,20-24,26-30,32-37H,9H2,1-2H3/t10?,17?,20?,21?,22?,23?,24?,26?,27?,28? Image of MNXM1370368
SMILES (mnx)[CH3:1][CH:10]1[CH:20]([OH:33])[CH:22]([OH:35])[CH:24]([OH:37])[CH:28]([O:42][CH:27]2[CH:23]([OH:36])[CH:21]([OH:34])[CH:17]([CH2:9][OH:29])[O:41][CH:26]2[C:19]2=[C:25]3[C:18](=[C:14]([OH:32])[CH:8]=[C:16]2[O:38][CH3:2])[C:13](=[O:31])[CH:7]=[C:15]([C:11]2=[CH:4][CH:6]=[C:12]([OH:30])[CH:5]=[CH:3]2)[O:40]3)[O:39]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:176169
chebi:176169
HFUYHHROXLKXRR-UHFFFAOYSA-N 		Isowertin 2''-rhamnoside
8-[4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxychromen-4-one
hmdb:HMDB0037417
HFUYHHROXLKXRR-UHFFFAOYSA-N 		Isowertin 2''-rhamnoside
2''-O-Rhamnosylisoswertisin
7-O-Methylvitexin 2''-O-beta-L-rhamnoside
8-[4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-4H-chromen-4-one
8-[4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxychromen-4-one
Isoswertisin 2''-O-rhamnoside
Isoswertisin 2''-rhamnoside

hmdb:HMDB37417 		secondary/obsolete/fantasy identifier