(Q105202154)

English

(1S,2R,5S,9R,12S,16R)-2-hydroxy-5-(2-hydroxyethyl)-1,5,12-trimethyl-10-oxatetracyclo[7.6.1.02,7.012,16]hexadec-7-en-11-one

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

2-Hydroxy-5-(2-hydroxyethyl)-1,5,12-trimethyl-10-oxatetracyclo[7.6.1.02,7.012,16]hexadec-7-en-11-one

1 reference

based on heuristic

inferred from SMILES

mass

334.21440944 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₃₀O₄

0 references

canonical SMILES

O=C1OC2C=C3CC(C)(CCO)CCC3(O)C4(C)CCCC1(C)C24

0 references

isomeric SMILES

C[C@]1(CCO)CC[C@@]2(O)C(=C[C@H]3OC(=O)[C@@]4(C)CCC[C@@]2(C)[C@@H]34)C1

0 references

found in taxon

Entoleuca mammata

1 reference

stated in

Isolation and structure elucidation of hymatoxins B - E and other phytotoxins from Hypoxylon mammatum fungal pathogen of leuce poplars

Identifiers

InChI

InChI=1S/C20H30O4/c1-17(9-10-21)7-8-20(23)13(12-17)11-14-15-18(2,16(22)24-14)5-4-6-19(15,20)3/h11,14-15,21,23H,4-10,12H2,1-3H3/t14-,15 ,17-,18 ,19 ,20-/m1/s1

0 references

InChIKey

OWNWFRHZRFTKOX-QBUATURESA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OWNWFRHZRFTKOX-QBUATURESA-N

(Q105202154)

(1S,2R,5S,9R,12S,16R)-2-hydroxy-5-(2-hydroxyethyl)-1,5,12-trimethyl-10-oxatetracyclo[7.6.1.02,7.012,16]hexadec-7-en-11-one

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