(Q77512045)

English

(8S,8a-R)-7-Deacetyl-1,O8,8,8a-tetrahydro-7-epi-sclerotiorin

bioactive natural product

In more languages

Statements

type of chemical entity

0 references

5-chloro-3-(3,5-dimethylhepta-1,3-dienyl)-7,8-dihydroxy-7-methyl-8,8a-dihydro-1H-isochromen-6-one

1 reference

based on heuristic

inferred from SMILES

(7S,8R,8aR)-5-chloro-3-[(1E,3E)-3,5-dimethylhepta-1,3-dienyl]-7,8-dihydroxy-7-methyl-8,8a-dihydro-1H-isochromen-6-one

1 reference

based on heuristic

inferred from SMILES

352.14413696 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(7R,8R,8aS)-5-chloro-3-[(1E,3E,5S)-3,5-dimethylhepta-1,3-dienyl]-7,8-dihydroxy-7-methyl-8,8a-dihydro-1H-isochromen-6-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

Isochromophilone III

1 reference

based on heuristic

inferred from InChI

(7R,8S,8aS)-5-chloro-3-[(1E,3E,5R)-3,5-dimethylhepta-1,3-dienyl]-7,8-dihydroxy-7-methyl-8,8a-dihydro-1H-isochromen-6-one

1 reference

based on heuristic

inferred from InChI

8-epi-isochromophilone III

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₉H₂₅ClO₄

0 references

canonical SMILES

O=C1C(Cl)=C2C=C(OCC2C(O)C1(O)C)C=CC(=CC(C)CC)C

0 references

isomeric SMILES

CC[C@H](C)/C=C(\C)/C=C/C1=CC2=C(C(=O)[C@@]([C@H]([C@@H]2CO1)O)(C)O)Cl

0 references

Penicillium sclerotiorum

1 reference

Azapbilones with Endothelin Receptor Binding Activity Produced by Penicillium sclerotiorum: Taxonomy, Fermentation, Isolation, Structure Elucidation and Biological Activity

Identifiers

InChI=1S/C19H25ClO4/c1-5-11(2)8-12(3)6-7-13-9-14-15(10-24-13)17(21)19(4,23)18(22)16(14)20/h6-9,11,15,17,21,23H,5,10H2,1-4H3/b7-6+,12-8+/t11-,15+,17-,19-/m0/s1

0 references

GJRRBURMULHWIH-XXAKLLPISA-N

2 references

language of work or name

Natural Product Atlas

language of work or name

2 references

language of work or name

matched by identifier from

GJRRBURMULHWIH-XXAKLLPISA-N

mapping relation type

1 reference

matched by identifier from

International Chemical Identifier

InChI=1S/C19H25ClO4/c1-5-11(2)8-12(3)6-7-13-9-14-15(10-24-13)17(21)19(4,23)18(22)16(14)20/h6-9,11,15,17,21,23H,5,10H2,1-4H3/b7-6+,12-8+/t11-,15+,17-,19-/m0/s1

UniChem compound ID

1 reference

Natural Product Atlas ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

GJRRBURMULHWIH-XXAKLLPISA-N

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