(Q105345050)

English

(1S,9S)-9,12,12-trimethyl-6-propan-2-yl-16-oxatetracyclo[7.6.1.01,11.03,8]hexadeca-3(8),4,6,10-tetraene-4,5-diol

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

chemical compound

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mass

328.203844756 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₁H₂₈O₃

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canonical SMILES

OC=1C(O)=C2C(=CC1C(C)C)C3(OC4(C(=C3)C(C)(C)CCC4)C2)C

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isomeric SMILES

CC(C)c1cc2c(c(O)c1O)C[C@@]13CCCC(C)(C)C1=C[C@]2(C)O3

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found in taxon

Premna serratifolia

1 reference

stated in

Potential anti-inflammatory diterpenes from Premna obtusifolia

Identifiers

InChI

InChI=1S/C21H28O3/c1-12(2)13-9-15-14(18(23)17(13)22)10-21-8-6-7-19(3,4)16(21)11-20(15,5)24-21/h9,11-12,22-23H,6-8,10H2,1-5H3/t20-,21-/m0/s1

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InChIKey

XZMYHERPNCJEBG-SFTDATJTSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

XZMYHERPNCJEBG-SFTDATJTSA-N

(Q105345050)

(1S,9S)-9,12,12-trimethyl-6-propan-2-yl-16-oxatetracyclo[7.6.1.01,11.03,8]hexadeca-3(8),4,6,10-tetraene-4,5-diol

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Identifiers

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