(Q105367440)

English

[(3aR,5aS,7S,9aR,9bS,10S,11aS)-7-hydroxy-6,6,9a-trimethyl-1-methylidene-2-oxo-3a,5,5a,7,8,9,9b,10,11,11a-decahydronaphtho[1,2-g][1]benzofuran-10-yl] acetate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

(7-Hydroxy-6,6,9a-trimethyl-1-methylidene-2-oxo-3a,5,5a,7,8,9,9b,10,11,11a-decahydronaphtho[1,2-g][1]benzofuran-10-yl) acetate

1 reference

based on heuristic

inferred from SMILES

mass

374.20932406 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₃₀O₅

0 references

canonical SMILES

O=C1OC2C3=CCC4C(C)(C)C(O)CCC4(C)C3C(OC(=O)C)CC2C1=C

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isomeric SMILES

C=C1C(=O)O[C@H]2C3=CC[C@@H]4C(C)(C)[C@@H](O)CC[C@@]4(C)[C@@H]3[C@@H](OC(C)=O)C[C@@H]12

0 references

found in taxon

Isodon henryi

1 reference

stated in

Taibaihenryiin C, a diterpenoid with a novel skeleton from Isodon henryi

Identifiers

InChI

InChI=1S/C22H30O5/c1-11-14-10-15(26-12(2)23)18-13(19(14)27-20(11)25)6-7-16-21(3,4)17(24)8-9-22(16,18)5/h6,14-19,24H,1,7-10H2,2-5H3/t14-,15-,16+,17-,18-,19-,22+/m0/s1

0 references

InChIKey

YWYUTUNHZMPPNO-QBKDGXDVSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YWYUTUNHZMPPNO-QBKDGXDVSA-N

(Q105367440)

[(3aR,5aS,7S,9aR,9bS,10S,11aS)-7-hydroxy-6,6,9a-trimethyl-1-methylidene-2-oxo-3a,5,5a,7,8,9,9b,10,11,11a-decahydronaphtho[1,2-g][1]benzofuran-10-yl] acetate

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Identifiers

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