(Q105309638)

English

[(1R,2R,4R,7S,9R,13R,15S,16S)-16-hydroxy-4,8,8,11,15-pentamethyl-12-oxo-3-oxatetracyclo[11.3.0.02,4.07,9]hexadec-10-en-13-yl] acetate

chemical compound

In more languages

Statements

type of chemical entity

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lathyrane diterpenoid

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376.224974124 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(-)-(12E,2S,3S,4R,5R,6R,9S,11S,15R)-15-acetoxy-5,6-epoxylathyr-12-en-3-ol-14-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₂H₃₂O₅

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canonical SMILES

O=C(OC12C(=O)C(=CC3C(CCC4(OC4C2C(O)C(C)C1)C)C3(C)C)C)C

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isomeric SMILES

CC(=O)O[C@]12C[C@H](C)[C@H](O)[C@@H]1[C@H]1O[C@]1(C)CC[C@H]1[C@@H](C=C(C)C2=O)C1(C)C

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Euphorbia micractina

1 reference

Lathyrane diterpenoids from the roots of Euphorbia micractina and their biological activities

Identifiers

InChI=1S/C22H32O5/c1-11-9-15-14(20(15,4)5)7-8-21(6)19(27-21)16-17(24)12(2)10-22(16,18(11)25)26-13(3)23/h9,12,14-17,19,24H,7-8,10H2,1-6H3/t12-,14-,15+,16+,17-,19+,21+,22+/m0/s1

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WOQBUFGEWLXSNN-MRAGDHIJSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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