(Q105196652)

English

Physapubenolide

group of stereoisomers with the chemical formula C₃₀H₄₀O₈

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Statements

instance of

group of stereoisomers

0 references

1 reference

528.27231824 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₀H₄₀O₈

0 references

canonical SMILES

O=C1OC(CC(=C1C)C)C(C)C2CC(OC(=O)C)C3(O)C4CC5OC65C(O)C=CC(=O)C6(C)C4CCC23C

0 references

found in taxon

Physalis peruviana

1 reference

stated in

Physapubenolide and pubescenin, two new ergostane-type steroids from Physalis pubescens L. (Solanaceae)

Physalis chenopodifolia

1 reference

stated in

Physapubenolide and pubescenin, two new ergostane-type steroids from Physalis pubescens L. (Solanaceae)

Identifiers

InChI

InChI=1S/C30H40O8/c1-14-11-21(37-26(34)15(14)2)16(3)19-12-24(36-17(4)31)29(35)20-13-25-30(38-25)23(33)8-7-22(32)28(30,6)18(20)9-10-27(19,29)5/h7-8,16,18-21,23-25,33,35H,9-13H2,1-6H3

0 references

InChIKey

OPYWYTLAPWWTKW-UHFFFAOYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OPYWYTLAPWWTKW-UHFFFAOYSA-N

ChEBI ID

167994

mapping relation type

exact match

2 references

stated in

ChEBI release 2022-06-13

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C30H40O8/c1-14-11-21(37-26(34)15(14)2)16(3)19-12-24(36-17(4)31)29(35)20-13-25-30(38-25)23(33)8-7-22(32)28(30,6)18(20)9-10-27(19,29)5/h7-8,16,18-21,23-25,33,35H,9-13H2,1-6H3

1 reference

Human Metabolome Database ID

HMDB0033976

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

OPYWYTLAPWWTKW-UHFFFAOYSA-N

(Q105196652)

Physapubenolide

Statements

Identifiers

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