(Q105179260)

English

3beta-Acetoxy-14-(angeloyloxy)cacalohastin

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

(6-Acetyloxy-9-methoxy-3,5-dimethyl-5,6-dihydrobenzo[f][1]benzofuran-4-yl)methyl 2-methylbut-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

398.172938552 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(5R,6R)-6-acetyloxy-9-methoxy-3,5-dimethyl-5,6-dihydrobenzo[f][1]benzofuran-4-yl]methyl (Z)-2-methylbut-2-enoate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₃H₂₆O₆

0 references

canonical SMILES

O=C(OCC1=C2C(OC=C2C)=C(OC)C=3C=CC(OC(=O)C)C(C31)C)C(=CC)C

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isomeric SMILES

C/C=C(/C)C(=O)OCc1c2c(c(OC)c3occ(C)c13)C=C[C@H](OC(C)=O)[C@@H]2C

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found in taxon

Senecio crispus

1 reference

stated in

Natürlich vorkommende Terpen-Derivate, 144: Über ein dimeres Furanoeremophilan und neue Cacalohastin-Derivate aus Senecio crispus Thumb. und Senecio macrospermus DC

Senecio macrospermus

1 reference

stated in

Natürlich vorkommende Terpen-Derivate, 144: Über ein dimeres Furanoeremophilan und neue Cacalohastin-Derivate aus Senecio crispus Thumb. und Senecio macrospermus DC

Identifiers

InChI

InChI=1S/C23H26O6/c1-7-12(2)23(25)28-11-17-19-13(3)10-27-22(19)21(26-6)16-8-9-18(29-15(5)24)14(4)20(16)17/h7-10,14,18H,11H2,1-6H3/b12-7-/t14-,18-/m0/s1

0 references

InChIKey

NHAJMPARCGACSM-PCEDJFSXSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

NHAJMPARCGACSM-PCEDJFSXSA-N

1 reference

(Q105179260)

3beta-Acetoxy-14-(angeloyloxy)cacalohastin

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