(Q104999299)

English

(3R,3aR,5'S,6aS,7R,8R,10R,10aS)-5'-(furan-3-yl)-3,10-dihydroxy-8-methylspiro[1,3,3a,4,5,6,6a,8,9,10-decahydrobenzo[d][2]benzofuran-7,3'-oxolane]-2'-one

chemical compound

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instance of

type of chemical entity

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subclass of

5'-(Furan-3-yl)-3,10-dihydroxy-8-methylspiro[1,3,3a,4,5,6,6a,8,9,10-decahydrobenzo[d][2]benzofuran-7,3'-oxolane]-2'-one

1 reference

based on heuristic

inferred from SMILES

mass

362.172938552 dalton

1 reference

1 reference

1 reference

C₂₀H₂₆O₆

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canonical SMILES

O=C1OC(C2=COC=C2)CC13C(C)CC(O)C45COC(O)C5CCCC34

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isomeric SMILES

C[C@@H]1C[C@@H](O)[C@]23CO[C@@H](O)[C@@H]2CCC[C@@H]3[C@@]12C[C@@H](c1ccoc1)OC2=O

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found in taxon

Teucrium kotschyanum

1 reference

stated in

Teuscorodin, teuscorodonin and 2-hydroxyteuscorolide, neo-clerodane diterpenoids from teucrium scorodonia

Identifiers

InChI

InChI=1S/C20H26O6/c1-11-7-16(21)20-10-25-17(22)13(20)3-2-4-15(20)19(11)8-14(26-18(19)23)12-5-6-24-9-12/h5-6,9,11,13-17,21-22H,2-4,7-8,10H2,1H3/t11-,13+,14+,15-,16-,17-,19-,20-/m1/s1

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InChIKey

FPNYZEUDIBOJQA-VHYOPMSSSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

FPNYZEUDIBOJQA-VHYOPMSSSA-N

(Q104999299)

(3R,3aR,5'S,6aS,7R,8R,10R,10aS)-5'-(furan-3-yl)-3,10-dihydroxy-8-methylspiro[1,3,3a,4,5,6,6a,8,9,10-decahydrobenzo[d][2]benzofuran-7,3'-oxolane]-2'-one

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