(Q27107406)

English

mulberrofuran C

chemical compound

In more languages

default for all languages

No label defined

No description defined

Statements

type of chemical entity

0 references

biogenic benzofuran

0 references

580.173332±0 dalton

1 reference

language of work or name

Mulberrofuran C (English)

5 October 2016

stereoisomer of

[(1R,2R,6S)-2-[2,6-dihydroxy-4-(6-hydroxy-1-benzofuran-2-yl)phenyl]-6-(2,4-dihydroxyphenyl)-4-methylcyclohex-3-en-1-yl]-(2,4-dihydroxyphenyl)methanone

1 reference

based on heuristic

inferred from InChI

(-)-Mulberrofuran J

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₄H₂₈O₉

1 reference

language of work or name

Mulberrofuran C (English)

5 October 2016

canonical SMILES

CC1=CC(C(C(C1)C2=C(C=C(C=C2)O)O)C(=O)C3=C(C=C(C=C3)O)O)C4=C(C=C(C=C4O)C5=CC6=C(O5)C=C(C=C6)O)O

1 reference

language of work or name

Mulberrofuran C (English)

5 October 2016

isomeric SMILES

CC1=C[C@H]([C@H]([C@@H](C1)C2=C(C=C(C=C2)O)O)C(=O)C3=C(C=C(C=C3)O)O)C4=C(C=C(C=C4O)C5=CC6=C(O5)C=C(C=C6)O)O

1 reference

language of work or name

Mulberrofuran C (English)

5 October 2016

1 reference

Absolute Configuration of Natural Diels-Alder Type Adducts from the Morus Root Bark

1 reference

Protein tyrosine phosphatase 1B inhibitors from Morus root bark

1 reference

Absolute Configuration of Natural Diels-Alder Type Adducts from the Morus Root Bark

Identifiers

InChI=1S/C34H28O9/c1-16-8-24(22-6-4-19(35)13-26(22)38)32(34(42)23-7-5-20(36)14-27(23)39)25(9-16)33-28(40)10-18(11-29(33)41)30-12-17-2-3-21(37)15-31(17)43-30/h2-7,9-15,24-25,32,35-41H,8H2,1H3/t24-,25+,32-/m0/s1

1 reference

language of work or name

Mulberrofuran C (English)

5 October 2016

WTGKDESIYCVAOP-UNTHUGQZSA-N

2 references

language of work or name

Mulberrofuran C (English)

5 October 2016

ChEBI release 2020-09-01

CAS Registry Number

2 references

language of work or name

mulberrofuran C (English)

5 October 2016

CAS Common Chemistry

7 April 2021

https://commonchemistry.cas.org/detail?cas_rn=77996-04-4

WTGKDESIYCVAOP-UNTHUGQZSA-N

1 reference

language of work or name

[(1S,2R,6R)-2-[2,6-Dihydroxy-4-(6-hydroxy-1-benzofuran-2-yl)phenyl]-6-(2,4-dihydroxyphenyl)-4-methyl-3-cyclohexen-1-yl](2,4-dihydroxyphenyl)methanone (English)

5 October 2016

2 references

language of work or name

Mulberrofuran C (English)

5 October 2016

matched by identifier from

WTGKDESIYCVAOP-UNTHUGQZSA-N

mapping relation type

2 references

language of work or name

mulberrofuran C (English)

5 October 2016

matched by identifier from

International Chemical Identifier

InChI=1S/C34H28O9/c1-16-8-24(22-6-4-19(35)13-26(22)38)32(34(42)23-7-5-20(36)14-27(23)39)25(9-16)33-28(40)10-18(11-29(33)41)30-12-17-2-3-21(37)15-31(17)43-30/h2-7,9-15,24-25,32,35-41H,8H2,1H3/t24-,25+,32-/m0/s1

1 reference

language of work or name

MULBERROFURAN C (English)

5 October 2016

UniChem compound ID

1 reference

DSSTox substance ID

1 reference

matched by identifier from

WTGKDESIYCVAOP-UNTHUGQZSA-N

DSSTOX compound identifier

DTXCID601426225

0 references

1 reference

language of work or name

mulberrofuran C (English)

5 October 2016

1 reference

language of work or name

mulberrofuran C (English)

5 October 2016

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