(Q105285012)

English

(1S,5aR,9aS)-10-hydroxy-1-(hydroxymethyl)-11-methoxy-6,6,9a-trimethyl-1,4,5,5a,8,9-hexahydronaphtho[1,2-g][2]benzofuran-3,7-dione

chemical compound

In more languages

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Statements

instance of

type of chemical entity

0 references

subclass of

10-Hydroxy-1-(hydroxymethyl)-11-methoxy-6,6,9a-trimethyl-1,4,5,5a,8,9-hexahydronaphtho[1,2-g][2]benzofuran-3,7-dione

1 reference

based on heuristic

inferred from SMILES

(5aR,9aS)-10-hydroxy-1-(hydroxymethyl)-11-methoxy-6,6,9a-trimethyl-1H,4H,5H,5aH,8H,9H-phenanthro[1,2-c]furan-3,7-dione

1 reference

based on heuristic

inferred from SMILES

mass

374.172938552 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₁H₂₆O₆

0 references

canonical SMILES

O=C1OC(C2=C(OC)C(O)=C3C(=C12)CCC4C(C(=O)CCC34C)(C)C)CO

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isomeric SMILES

COc1c(O)c2c(c3c1[C@@H](CO)OC3=O)CC[C@H]1C(C)(C)C(=O)CC[C@]21C

0 references

found in taxon

Swartzia arborescens

1 reference

stated in

Swartziarboreols A-E, Five New Cassane Diterpenoids from Swartzia arborescens (Aubl.) Pittier

Identifiers

InChI

InChI=1S/C21H26O6/c1-20(2)12-6-5-10-14-15(11(9-22)27-19(14)25)18(26-4)17(24)16(10)21(12,3)8-7-13(20)23/h11-12,22,24H,5-9H2,1-4H3/t11-,12+,21+/m1/s1

0 references

InChIKey

VFAWCZCJUTVMRS-IDFMNXDXSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VFAWCZCJUTVMRS-IDFMNXDXSA-N

1 reference

(Q105285012)

(1S,5aR,9aS)-10-hydroxy-1-(hydroxymethyl)-11-methoxy-6,6,9a-trimethyl-1,4,5,5a,8,9-hexahydronaphtho[1,2-g][2]benzofuran-3,7-dione

Statements

Identifiers

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