(Q27147412)

CHEBI:77809 (English)

7-O-methylvitexin 2''-O-beta-L-rhamnoside(1-)

8 October 2016

stereoisomer of

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₈H₃₁O₁₄⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CC1C(C(C(C(O1)OC2C(C(C(OC2C3=C(C=C(C4=C3OC(=CC4=O)C5=CC=C(C=C5)O)[O-])OC)CO)O)O)O)O)O

1 reference

CHEBI:77809 (English)

8 October 2016

isomeric SMILES

C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2C3=C(C=C(C4=C3OC(=CC4=O)C5=CC=C(C=C5)O)[O-])OC)CO)O)O)O)O)O

1 reference

CHEBI:77809 (English)

InChI=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/p-1/t10-,17+,20-,21+,22+,23-,24+,26-,27+,28-/m0/s1

8 October 2016

Identifiers

InChI

1 reference

CHEBI:77809 (English)

HFUYHHROXLKXRR-WBXLRLGPSA-M

8 October 2016

InChIKey

2 references

CHEBI:77809 (English)

8 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(1S)-1,5-Anhydro-2-O-(6-deoxy-alpha-L-mannopyranosyl)-1-[2-(4-hydroxyphenyl)-7-methoxy-5-oxido-4-oxo-4H-chromen-8-yl]-D-glucitol (English)

8 October 2016

2 references

CHEBI:77809 (English)

matched by identifier from

8 October 2016

InChIKey

HFUYHHROXLKXRR-WBXLRLGPSA-M

ChEBI ID

77809

mapping relation type

2 references

7-O-methylvitexin 2''-O-alpha-L-rhamnoside(1-) (English)