(Q115971849)

English

[(1S,2S,3S,4R,5S,6R)-2,3,5-trihydroxy-4,6-dimethoxycyclohexyl] (4R,4aS,8aR)-6-methyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydronaphthalene-1-carboxylate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

cadinane sesquiterpenoid

1 reference

based on heuristic

inferred from SMILES

mass

424.246103492 dalton

1 reference

1 reference

inferred from InChIKey

chemical formula

C₂₃H₃₆O₇

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canonical SMILES

O=C(OC1C(O)C(O)C(OC)C(O)C1OC)C2=CCC(C3C=C(C)CCC23)C(C)C

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isomeric SMILES

CO[C@@H]1[C@@H](O)[C@H](O)[C@H](OC(=O)C2=CC[C@H](C(C)C)[C@H]3C=C(C)CC[C@@H]23)[C@H](OC)[C@H]1O

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found in taxon

Colletotrichum higginsianum

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stated in

Deleting a Chromatin Remodeling Gene Increases the Diversity of Secondary Metabolites Produced by Colletotrichum higginsianum

Identifiers

InChI

InChI=1S/C23H36O7/c1-11(2)13-8-9-15(14-7-6-12(3)10-16(13)14)23(27)30-22-18(25)17(24)20(28-4)19(26)21(22)29-5/h9-11,13-14,16-22,24-26H,6-8H2,1-5H3/t13-,14+,16-,17+,18+,19+,20-,21-,22+/m1/s1

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InChIKey

UFNLIQIFTAMKKF-XGGNSGRDSA-N

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2 references

3 January 2023

inferred from InChIKey

matched by identifier from

InChIKey

UFNLIQIFTAMKKF-XGGNSGRDSA-N

1 reference

(Q115971849)

[(1S,2S,3S,4R,5S,6R)-2,3,5-trihydroxy-4,6-dimethoxycyclohexyl] (4R,4aS,8aR)-6-methyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydronaphthalene-1-carboxylate

Statements

Identifiers

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