(Q27103790)

rhamnosylisoorientin (English)

5 October 2016

chemical formula

C₂₇H₃₀O₁₅

1 reference

rhamnosylisoorientin (English)

5 October 2016

canonical SMILES

CC1C(C(C(C(O1)OC2C(C(C(OC2C3=C(C=C4C(=C3O)C(=O)C=C(O4)C5=CC(=C(C=C5)O)O)O)CO)O)O)O)O)O

1 reference

rhamnosylisoorientin (English)

5 October 2016

isomeric SMILES

C[C@H]1[C@@H]([C@H]([C@H](C(O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2C3=C(C=C4C(=C3O)C(=O)C=C(O4)C5=CC(=C(C=C5)O)O)O)CO)O)O)O)O)O

1 reference

rhamnosylisoorientin (English)

InChI=1S/C27H30O15/c1-8-19(33)22(36)24(38)27(39-8)42-26-23(37)20(34)16(7-28)41-25(26)18-13(32)6-15-17(21(18)35)12(31)5-14(40-15)9-2-3-10(29)11(30)4-9/h2-6,8,16,19-20,22-30,32-38H,7H2,1H3/t8-,16+,19-,20+,22+,23-,24+,25-,26+,27?/m0/s1

5 October 2016

Identifiers

InChI

1 reference

rhamnosylisoorientin (English)

IUYFTHKQEWZTHY-LQQQXCKLSA-N

5 October 2016

InChIKey

2 references

rhamnosylisoorientin (English)

5 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(1S)-1,5-Anhydro-2-O-(6-deoxy-L-mannopyranosyl)-1-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-6-yl]-D-glucitol (English)

5 October 2016

2 references

rhamnosylisoorientin (English)

matched by identifier from

5 October 2016

InChIKey

IUYFTHKQEWZTHY-LQQQXCKLSA-N

Reaxys registry number

8028926

1 reference

isoorientin 2''-O-rhamnoside (English)

5 October 2016

ChEBI ID

28596

mapping relation type

2 references

isoorientin 2''-O-rhamnoside (English)

matched by identifier from

5 October 2016

International Chemical Identifier

InChI

InChI=1S/C27H30O15/c1-8-19(33)22(36)24(38)27(39-8)42-26-23(37)20(34)16(7-28)41-25(26)18-13(32)6-15-17(21(18)35)12(31)5-14(40-15)9-2-3-10(29)11(30)4-9/h2-6,8,16,19-20,22-30,32-38H,7H2,1H3/t8-,16+,19-,20+,22+,23-,24+,25-,26+,27?/m0/s1

1 reference

1 reference

isoorientin 2''-O-rhamnoside (English)