(Q82902946)

English

6-Hydroxysandoricin

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

chemical compound

0 references

mass

604.25197672 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₁H₄₀O₁₂

0 references

canonical SMILES

O=C(OC1CC2OC34C(=C)C(CC(OC(=O)C)C4(C)C(OC(=O)C3O)C5=COC=C5)C2(C)C(C(O)C(=O)OC)C1(C)C)C

0 references

found in taxon

Santol

1 reference

stated in

Limonoid antifeedants from seed of Sandoricum koetjape

Identifiers

InChI

InChI=1S/C31H40O12/c1-14-18-11-21(41-16(3)33)30(7)25(17-9-10-39-13-17)42-27(37)24(35)31(14,30)43-20-12-19(40-15(2)32)28(4,5)23(29(18,20)6)22(34)26(36)38-8/h9-10,13,18-25,34-35H,1,11-12H2,2-8H3

0 references

InChIKey

NKHYHRMLCJNKHW-UHFFFAOYSA-N

0 references

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

NKHYHRMLCJNKHW-UHFFFAOYSA-N

ChEBI ID

185400

mapping relation type

exact match

2 references

stated in

ChEBI release 2022-06-13

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C31H40O12/c1-14-18-11-21(41-16(3)33)30(7)25(17-9-10-39-13-17)42-27(37)24(35)31(14,30)43-20-12-19(40-15(2)32)28(4,5)23(29(18,20)6)22(34)26(36)38-8/h9-10,13,18-25,34-35H,1,11-12H2,2-8H3

1 reference

1 reference

matched by identifier from

InChIKey

NKHYHRMLCJNKHW-UHFFFAOYSA-N

DSSTOX compound identifier

DTXCID601356967

0 references

Human Metabolome Database ID

HMDB0037556

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

NKHYHRMLCJNKHW-UHFFFAOYSA-N

(Q82902946)

6-Hydroxysandoricin

Statements

Identifiers

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