(Q104973274)

English

methyl (1S,4S,5R,9S,10R,13R,14S)-14-hydroxy-14-(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylate

chemical compound

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instance of

type of chemical entity

0 references

subclass of

methyl 14-hydroxy-14-(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane-5-carboxylate

1 reference

based on heuristic

inferred from SMILES

mass

350.245709568 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

Methyl 16alpha,17-dihydroxy-ent-kauran-19-oate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₁H₃₄O₄

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canonical SMILES

O=C(OC)C1(C)CCCC2(C)C1CCC34CC(CCC32)C(O)(CO)C4

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isomeric SMILES

COC(=O)[C@]1(C)CCC[C@]2(C)[C@@H]1CC[C@@]13C[C@@H](CC[C@H]12)[C@](O)(CO)C3

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found in taxon

Helianthus petiolaris

1 reference

stated in

Ent-pimaranes, ent-kauranes, Heliangolides and other Constituents of three Helianthus species

Identifiers

InChI

InChI=1S/C21H34O4/c1-18-8-4-9-19(2,17(23)25-3)15(18)7-10-20-11-14(5-6-16(18)20)21(24,12-20)13-22/h14-16,22,24H,4-13H2,1-3H3/t14-,15+,16+,18-,19-,20+,21-/m1/s1

0 references

InChIKey

CZYWWRRSTIZTFL-USANHHIESA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

CZYWWRRSTIZTFL-USANHHIESA-N

1 reference

(Q104973274)

methyl (1S,4S,5R,9S,10R,13R,14S)-14-hydroxy-14-(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylate

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