(Q105122744)

English

(5S)-5-[(1S,2S,5R,6S,9R,10R,13R,15S)-15-hydroxy-9,10,14,14-tetramethyl-16-oxapentacyclo[13.2.2.01,13.02,10.05,9]nonadecan-6-yl]-5-methyloxolan-2-one

chemical compound

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instance of

type of chemical entity

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1 reference

5-(15-Hydroxy-9,10,14,14-tetramethyl-16-oxapentacyclo[13.2.2.01,13.02,10.05,9]nonadecan-6-yl)-5-methyloxolan-2-one

1 reference

based on heuristic

inferred from SMILES

mass

430.308309824 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₇H₄₂O₄

0 references

canonical SMILES

O=C1OC(C)(CC1)C2CCC3(C)C2CCC4C3(C)CCC5C(C)(C)C6(O)OCC54CC6

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isomeric SMILES

CC1(C)[C@@H]2CC[C@]3(C)[C@H](CC[C@@H]4[C@@H]([C@]5(C)CCC(=O)O5)CC[C@]43C)[C@@]23CC[C@]1(O)OC3

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found in taxon

Cleome amblyocarpa

1 reference

stated in

Dammarane triterpenes from Cleome amblyocarpa

Identifiers

InChI

InChI=1S/C27H42O4/c1-22(2)19-9-12-24(4)20(26(19)14-15-27(22,29)30-16-26)7-6-17-18(8-11-23(17,24)3)25(5)13-10-21(28)31-25/h17-20,29H,6-16H2,1-5H3/t17-,18+,19+,20+,23-,24-,25+,26-,27+/m1/s1

0 references

InChIKey

IYHHZIXQJXKUSA-KMSJUIDMSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

IYHHZIXQJXKUSA-KMSJUIDMSA-N

(Q105122744)

(5S)-5-[(1S,2S,5R,6S,9R,10R,13R,15S)-15-hydroxy-9,10,14,14-tetramethyl-16-oxapentacyclo[13.2.2.01,13.02,10.05,9]nonadecan-6-yl]-5-methyloxolan-2-one

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