(Q105033571)

English

(7,10-diacetyloxy-5-benzoyloxy-3-ethenyl-2,6,10a-trihydroxy-2,4b,8,8-tetramethyl-1-oxo-4,4a,5,6,7,8a,9,10-octahydro-3H-phenanthren-4-yl) benzoate

group of stereoisomers with the chemical formula C₃₈H₄₄O₁₂

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

692.2832768480001 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₈H₄₄O₁₂

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canonical SMILES

O=C(OC1C(C=C)C(O)(C(=O)C2(O)C(OC(=O)C)CC3C(C)(C)C(OC(=O)C)C(O)C(OC(=O)C=4C=CC=CC4)C3(C)C12)C)C=5C=CC=CC5

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found in taxon

Orthosiphon aristatus

1 reference

stated in

Highly-oxygenated isopimarane-type diterpenes from Orthosiphon stamineus of Indonesia and their nitric oxide inhibitory activity

Identifiers

InChI

InChI=1S/C38H44O12/c1-8-24-28(49-32(42)22-15-11-9-12-16-22)29-36(6)25(19-26(47-20(2)39)38(29,46)34(44)37(24,7)45)35(4,5)30(48-21(3)40)27(41)31(36)50-33(43)23-17-13-10-14-18-23/h8-18,24-31,41,45-46H,1,19H2,2-7H3

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InChIKey

HTQXQVMIWWLNLG-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HTQXQVMIWWLNLG-UHFFFAOYSA-N

(Q105033571)

(7,10-diacetyloxy-5-benzoyloxy-3-ethenyl-2,6,10a-trihydroxy-2,4b,8,8-tetramethyl-1-oxo-4,4a,5,6,7,8a,9,10-octahydro-3H-phenanthren-4-yl) benzoate

Statements

Identifiers

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