(Q104975038)

English

Atranone Q

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

6-hydroxy-4-isopropyl-7,11,13a-trimethyl-9-(2-oxopropyl)-4aH,5H,6H,9H,11H,12H,13H-cycloundeca[b]pyran-2,10-dione

1 reference

based on heuristic

inferred from SMILES

mass

390.240624188 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₃H₃₄O₅

0 references

canonical SMILES

O=C1OC2(C)CCC(C(=O)C(C=C(C)C(O)CC2C(=C1)C(C)C)CC(=O)C)C

0 references

isomeric SMILES

CC(=O)C[C@H]1/C=C(\C)[C@@H](O)C[C@H]2C(C(C)C)=CC(=O)O[C@]2(C)CC[C@@H](C)C1=O

0 references

found in taxon

Stachybotrys chartarum

1 reference

stated in

Antimicrobial Dolabellanes and Atranones from a Marine-Derived Strain of the Toxigenic Fungus Stachybotrys chartarum

Identifiers

InChI

InChI=1S/C23H34O5/c1-13(2)18-11-21(26)28-23(6)8-7-14(3)22(27)17(10-16(5)24)9-15(4)20(25)12-19(18)23/h9,11,13-14,17,19-20,25H,7-8,10,12H2,1-6H3/b15-9+/t14-,17-,19+,20+,23-/m1/s1

0 references

InChIKey

DBYUXSBRACONCI-MNSYTRPTSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

DBYUXSBRACONCI-MNSYTRPTSA-N

ChEBI ID

224453

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C23H34O5/c1-13(2)18-11-21(26)28-23(6)8-7-14(3)22(27)17(10-16(5)24)9-15(4)20(25)12-19(18)23/h9,11,13-14,17,19-20,25H,7-8,10,12H2,1-6H3/b15-9+/t14-,17-,19+,20+,23-/m1/s1

1 reference

Natural Product Atlas ID

NPA025282

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

DBYUXSBRACONCI-MNSYTRPTSA-N

(Q104975038)

Atranone Q

Statements

Identifiers

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