(Q105267218)

English

(3R,4aS,7R,8S,8aS)-3,4'-dihydroxy-4,4,7,8a-tetramethylspiro[2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-5,6-dihydro-3H-furo[3,2-f]isoindole]-7'-one

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

drimane sesquiterpenoid

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isoindole alkaloid

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mass

385.225308472 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₃H₃₁NO₄

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canonical SMILES

CC1CCC2C(C)(C)C(O)CCC2(C)C12Cc1c(cc3c(c1O)CNC3=O)O2

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isomeric SMILES

C[C@@H]1CC[C@H]2C(C)(C)[C@H](O)CC[C@]2(C)[C@]12Cc1c(cc3c(c1O)CNC3=O)O2

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found in taxon

Stachybotrys chartarum

1 reference

stated in

Novel Spirodihydrobenzofuranlactams as Antagonists of Endothelin and as Inhibitors of HIV-1 Protease Produced by Stachybotrys sp. I. Fermentation, Isolation and Biological Activity.

Identifiers

InChI

InChI=1S/C23H31NO4/c1-12-5-6-17-21(2,3)18(25)7-8-22(17,4)23(12)10-14-16(28-23)9-13-15(19(14)26)11-24-20(13)27/h9,12,17-18,25-26H,5-8,10-11H2,1-4H3,(H,24,27)/t12-,17+,18-,22+,23+/m1/s1

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InChIKey

TYBIMLPPWZKUEC-SWWUMETJSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

TYBIMLPPWZKUEC-SWWUMETJSA-N

(Q105267218)

(3R,4aS,7R,8S,8aS)-3,4'-dihydroxy-4,4,7,8a-tetramethylspiro[2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-5,6-dihydro-3H-furo[3,2-f]isoindole]-7'-one

Statements

Identifiers

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