(Q105026222)

English

(4R,5R,6R)-5-[(4R,7R,8S,10R,11R)-8,10-dihydroxy-11-(hydroxymethyl)-4,7-dimethyltridecyl]-6-ethyl-4-hydroxy-4,5-dimethylcyclohex-2-en-1-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

1 reference

440.350174636 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₆H₄₈O₅

0 references

canonical SMILES

O=C1C=CC(O)(C)C(C)(CCCC(C)CCC(C)C(O)CC(O)C(CO)CC)C1CC

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isomeric SMILES

CC[C@H](CO)[C@H](O)C[C@H](O)[C@H](C)CC[C@H](C)CCC[C@]1(C)[C@@H](CC)C(=O)C=C[C@@]1(C)O

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found in taxon

Momordica charantia

1 reference

stated in

Triterpenes, A sterol and A monocyclic alcohol from Momordica charantia

Identifiers

InChI

InChI=1S/C26H48O5/c1-7-20(17-27)24(30)16-23(29)19(4)12-11-18(3)10-9-14-25(5)21(8-2)22(28)13-15-26(25,6)31/h13,15,18-21,23-24,27,29-31H,7-12,14,16-17H2,1-6H3/t18-,19-,20-,21+,23+,24-,25-,26-/m1/s1

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InChIKey

HDAGCVMZABLHLE-QBTKHTKJSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HDAGCVMZABLHLE-QBTKHTKJSA-N

(Q105026222)

(4R,5R,6R)-5-[(4R,7R,8S,10R,11R)-8,10-dihydroxy-11-(hydroxymethyl)-4,7-dimethyltridecyl]-6-ethyl-4-hydroxy-4,5-dimethylcyclohex-2-en-1-one

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Identifiers

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