(Q104909375)

English

1-Acetyl-3,14,20-trihydroxywitha-5,24-dienolide 3-glucoside

group of stereoisomers with the chemical formula C₃₆H₅₄O₁₂

In more languages

edit

Statements

instance of

group of stereoisomers

0 references

1 reference

678.3615271680001 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₆H₅₄O₁₂

0 references

canonical SMILES

O=C1OC(CC(=C1C)C)C(O)(C)C2CCC3(O)C4CC=C5CC(OC6OC(CO)C(O)C(O)C6O)CC(OC(=O)C)C5(C)C4CCC23C

0 references

Identifiers

InChI

InChI=1S/C36H54O12/c1-17-13-27(48-31(42)18(17)2)35(6,43)25-10-12-36(44)23-8-7-20-14-21(46-32-30(41)29(40)28(39)24(16-37)47-32)15-26(45-19(3)38)34(20,5)22(23)9-11-33(25,36)4/h7,21-30,32,37,39-41,43-44H,8-16H2,1-6H3

0 references

InChIKey

ACXRDVCAKSUCPM-UHFFFAOYSA-N

0 references

2 references

26 December 2021

matched by identifier from

InChIKey

ACXRDVCAKSUCPM-UHFFFAOYSA-N

ChEBI ID

168690

mapping relation type

exact match

2 references

stated in

ChEBI release 2022-06-13

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C36H54O12/c1-17-13-27(48-31(42)18(17)2)35(6,43)25-10-12-36(44)23-8-7-20-14-21(46-32-30(41)29(40)28(39)24(16-37)47-32)15-26(45-19(3)38)34(20,5)22(23)9-11-33(25,36)4/h7,21-30,32,37,39-41,43-44H,8-16H2,1-6H3

1 reference

Human Metabolome Database ID

HMDB0033572

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

ACXRDVCAKSUCPM-UHFFFAOYSA-N

(Q104909375)

1-Acetyl-3,14,20-trihydroxywitha-5,24-dienolide 3-glucoside

Statements

Identifiers

Sitelinks

Wikipedia(0 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)