(Q105375689)

English

Solanocardinol

group of stereoisomers with the chemical formula C₂₇H₄₅NO₃

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Statements

instance of

group of stereoisomers

0 references

1 reference

431.3399443 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₇H₄₅NO₃

0 references

canonical SMILES

OC1CCC2(C)C(CCC3C2CCC4(C)C3CC5OC6(O)CC(C)CNC6C(C)C54)C1

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found in taxon

tomato

1 reference

stated in

Lycopersiconol, a pregnane derivative from tomato stock roots

Solanum tetramerum

1 reference

stated in

3-Desamino-3α-hydroxysolanocapsine—a steroidal alkaloid from Solanum aculeatum☆

Identifiers

InChI

InChI=1S/C27H45NO3/c1-15-13-27(30)24(28-14-15)16(2)23-22(31-27)12-21-19-6-5-17-11-18(29)7-9-25(17,3)20(19)8-10-26(21,23)4/h15-24,28-30H,5-14H2,1-4H3

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InChIKey

ZHFCFFSSVSIEIR-UHFFFAOYSA-N

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CAS Registry Number

138665-46-0

1 reference

stated in

CAS (formerly Chemical Abstracts Service)

25 January 2022

1 reference

17 September 2022

inferred from InChIKey

1 reference

1 reference

matched by identifier from

InChIKey

ZHFCFFSSVSIEIR-UHFFFAOYSA-N

Human Metabolome Database ID

HMDB0038836

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

ZHFCFFSSVSIEIR-UHFFFAOYSA-N

KNApSAcK ID

C00057043

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

ZHFCFFSSVSIEIR-UHFFFAOYSA-N

(Q105375689)

Solanocardinol

Statements

Identifiers

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