(Q105302100)

English

WCURSOKOPWMZOC-XSQPDRAFSA-N

chemical compound

In more languages

Statements

type of chemical entity

0 references

9,10,11,27,28,29,32,33,34-Nonahydroxy-6,16,19,24,37-pentaoxo-3-(3,4,5-trihydroxybenzoyl)oxy-2,5,15,20,23,38-hexaoxaheptacyclo[19.18.0.04,22.07,12.013,18.025,30.031,36]nonatriaconta-7,9,11,13,25,27,29,31,33,35-decaene-14-carboxylic acid

1 reference

based on heuristic

inferred from SMILES

952.081795636 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₄₁H₂₈O₂₇

0 references

canonical SMILES

O=C(O)C=1OC(=O)CC2C(=O)OC3C4OC(OC(=O)C5=CC(O)=C(O)C(O)=C5)C(OC(=O)C=6C=C(O)C(O)=C(O)C6C12)C3OC(=O)C7=CC(O)=C(O)C(O)=C7C=8C(O)=C(O)C(O)=CC8C(=O)OC4

0 references

isomeric SMILES

O=C1C[C@H]2C(=O)O[C@H]3[C@@H]4OC(=O)c5cc(O)c(O)c(O)c5-c5c(cc(O)c(O)c5O)C(=O)OC[C@H]3O[C@@H](OC(=O)c3cc(O)c(O)c(O)c3)[C@@H]4OC(=O)c3cc(O)c(O)c(O)c3C2=C(C(=O)O)O1

0 references

Phyllanthus flexuosus

1 reference

Tannins and Related Polyphenols of Euphorbiaceous Plants. IX. Hydrolyzable Tannins with 1C4 Glucose Core from Phyllanthus flexuosus MUELL. ARG.

Identifiers

InChI=1S/C41H28O27/c42-13-1-8(2-14(43)24(13)48)36(57)68-41-34-33-31(65-40(61)12-6-19(47)64-32(35(55)56)23(12)22-11(39(60)67-34)5-17(46)27(51)30(22)54)18(63-41)7-62-37(58)9-3-15(44)25(49)28(52)20(9)21-10(38(59)66-33)4-16(45)26(50)29(21)53/h1-5,12,18,31,33-34,41-46,48-54H,6-7H2,(H,55,56)/t12-,18-,31-,33+,34-,41+/m1/s1

0 references

WCURSOKOPWMZOC-XSQPDRAFSA-N

0 references

2 references

15 September 2022

matched by identifier from

WCURSOKOPWMZOC-XSQPDRAFSA-N

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