(Q105270922)

English

Sibiricinone C

group of stereoisomers with the chemical formula C₂₁H₃₂O₆

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Statements

instance of

group of stereoisomers

0 references

1 reference

380.219888744 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₁H₃₂O₆

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canonical SMILES

O=C1OC(OC)C=C1CCC2(O)C(C(=O)C(O)C3C(C)(C)CCCC32C)C

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isomeric SMILES

COC1C=C(CC[C@@]2(O)[C@H](C)C(=O)[C@@H](O)[C@H]3C(C)(C)CCC[C@@]32C)C(=O)O1

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found in taxon

Leonurus sibiricus

1 reference

stated in

Labdane Diterpenes From Leonurus Persicus

Identifiers

InChI

InChI=1S/C21H32O6/c1-12-15(22)16(23)17-19(2,3)8-6-9-20(17,4)21(12,25)10-7-13-11-14(26-5)27-18(13)24/h11-12,14,16-17,23,25H,6-10H2,1-5H3/t12-,14?,16-,17+,20+,21-/m1/s1

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InChIKey

UEHATVMLPFUSJH-GSWHXBPJSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

UEHATVMLPFUSJH-GSWHXBPJSA-N

1 reference

(Q105270922)

Sibiricinone C

Statements

Identifiers

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