(Q104939040)

English

(7,8-Diacetyloxy-9-benzoyloxy-14-hydroxy-6,6,10,17-tetramethyl-2,16,18-trioxapentacyclo[9.7.0.01,3.05,10.013,17]octadecan-12-yl) benzoate

group of stereoisomers with the chemical formula C₃₇H₄₂O₁₂

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

678.267626784 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₇H₄₂O₁₂

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canonical SMILES

O=C(OC1C2C(O)COC2(OC34OC4CC5C(C)(C)C(OC(=O)C)C(OC(=O)C)C(OC(=O)C=6C=CC=CC6)C5(C)C13)C)C=7C=CC=CC7

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found in taxon

Orthosiphon aristatus

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stated in

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

Identifiers

InChI

InChI=1S/C37H42O12/c1-19(38)44-28-30(45-20(2)39)34(3,4)24-17-25-37(48-25)29(35(24,5)31(28)47-33(42)22-15-11-8-12-16-22)27(26-23(40)18-43-36(26,6)49-37)46-32(41)21-13-9-7-10-14-21/h7-16,23-31,40H,17-18H2,1-6H3

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InChIKey

BNVISAOEFRYBOH-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

BNVISAOEFRYBOH-UHFFFAOYSA-N

(Q104939040)

(7,8-Diacetyloxy-9-benzoyloxy-14-hydroxy-6,6,10,17-tetramethyl-2,16,18-trioxapentacyclo[9.7.0.01,3.05,10.013,17]octadecan-12-yl) benzoate

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