(Q104914572)

English

[(1S,2E,6Z,8S,9S,10S)-10-acetyloxy-6-(acetyloxymethyl)-9-[(2S)-1-acetyloxypropan-2-yl]-8-hydroxy-2-methylcyclodeca-2,6-dien-1-yl] (2R,3S)-3-acetyloxy-2-methylbutanoate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

[10-Acetyloxy-6-(acetyloxymethyl)-9-(1-acetyloxypropan-2-yl)-8-hydroxy-2-methylcyclodeca-2,6-dien-1-yl] 3-acetyloxy-2-methylbutanoate

1 reference

based on heuristic

inferred from SMILES

mass

554.272712164 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(1S,2E,6Z,8R,9S,10S)-10-acetyloxy-6-(acetyloxymethyl)-9-[(2S)-1-acetyloxypropan-2-yl]-8-hydroxy-2-methylcyclodeca-2,6-dien-1-yl] (2S,3R)-3-acetyloxy-2-methylbutanoate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₈H₄₂O₁₁

0 references

canonical SMILES

O=C(OCC1=CC(O)C(C(OC(=O)C)C(OC(=O)C(C)C(OC(=O)C)C)C(=CCC1)C)C(C)COC(=O)C)C

0 references

isomeric SMILES

CC(=O)OC/C1=C\[C@H](O)[C@H]([C@H](C)COC(C)=O)[C@H](OC(C)=O)[C@@H](OC(=O)[C@H](C)[C@H](C)OC(C)=O)/C(C)=C/CC1

0 references

found in taxon

Salvia chinensis

1 reference

stated in

New germacrane sesquiterpenes from Salvia chinensis

Identifiers

InChI

InChI=1S/C28H42O11/c1-15-10-9-11-23(14-36-20(6)30)12-24(33)25(16(2)13-35-19(5)29)27(38-22(8)32)26(15)39-28(34)17(3)18(4)37-21(7)31/h10,12,16-18,24-27,33H,9,11,13-14H2,1-8H3/b15-10+,23-12-/t16-,17-,18+,24+,25+,26+,27+/m1/s1

0 references

InChIKey

AMEGJGMXMRBPRX-KTGIAUDFSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

AMEGJGMXMRBPRX-KTGIAUDFSA-N

(Q104914572)

[(1S,2E,6Z,8S,9S,10S)-10-acetyloxy-6-(acetyloxymethyl)-9-[(2S)-1-acetyloxypropan-2-yl]-8-hydroxy-2-methylcyclodeca-2,6-dien-1-yl] (2R,3S)-3-acetyloxy-2-methylbutanoate

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