(Q27136175)

English

(-)-(6Z,12E,2S,3S,4R,5R,9S,11S,15R)-15-cinnamoyloxy-3,5-di-O-isopropylidenelathyra-6,12-dien-14-one

chemical compound

In more languages

default for all languages

No label defined

No description defined

Statements

type of chemical entity

0 references

[3,6,6,10,14-Pentamethyl-2-oxo-11,13-bis(prop-1-en-2-yloxy)-1-tricyclo[10.3.0.05,7]pentadeca-3,9-dienyl] 3-phenylprop-2-enoate

1 reference

based on heuristic

inferred from InChIKey

544.319±0 dalton

1 reference

language of work or name

CHEBI:67702 (English)

7 October 2016

chemical formula

C₃₅H₄₄O₅

1 reference

language of work or name

CHEBI:67702 (English)

7 October 2016

canonical SMILES

CC1CC2(C(C1OC(=C)C)C(C(=CCC3C(C3(C)C)C=C(C2=O)C)C)OC(=C)C)OC(=O)C=CC4=CC=CC=C4

1 reference

language of work or name

CHEBI:67702 (English)

7 October 2016

isomeric SMILES

C[C@H]1C[C@]2([C@H]([C@H]1OC(=C)C)[C@H](/C(=C\C[C@H]3[C@H](C3(C)C)/C=C(/C2=O)\C)/C)OC(=C)C)OC(=O)/C=C/C4=CC=CC=C4

1 reference

language of work or name

CHEBI:67702 (English)

7 October 2016

Identifiers

InChI=1S/C35H44O5/c1-21(2)38-31-23(5)15-17-27-28(34(27,8)9)19-24(6)33(37)35(20-25(7)32(30(31)35)39-22(3)4)40-29(36)18-16-26-13-11-10-12-14-26/h10-16,18-19,25,27-28,30-32H,1,3,17,20H2,2,4-9H3/b18-16+,23-15-,24-19+/t25-,27-,28+,30-,31-,32-,35+/m0/s1

1 reference

language of work or name

CHEBI:67702 (English)

7 October 2016

MXEVRBCQVDKHEV-CFZYZPLLSA-N

2 references

language of work or name

CHEBI:67702 (English)

7 October 2016

ChEBI release 2020-09-01

1 reference

language of work or name

(1aR,2E,4aR,6S,7S,7aR,8R,9Z,11aS)-7,8-Bis(isopropenyloxy)-1,1,3,6,9-pentamethyl-4-oxo-1,1a,4,5,6,7,7a,8,11,11a-decahydro-4aH-cyclopenta[a]cyclopropa[f][11]annulen-4a-yl (2E)-3-phenylacrylate (English)

7 October 2016

2 references

language of work or name

CHEBI:67702 (English)

7 October 2016

matched by identifier from

MXEVRBCQVDKHEV-CFZYZPLLSA-N

mapping relation type

2 references

language of work or name

(-)-(6Z,12E,2S,3S,4R,5R,9S,11S,15R)-15-cinnamoyloxy-3,5-di-O-isopropylidenelathyra-6,12-dien-14-one (English)

7 October 2016

matched by identifier from

International Chemical Identifier

InChI=1S/C35H44O5/c1-21(2)38-31-23(5)15-17-27-28(34(27,8)9)19-24(6)33(37)35(20-25(7)32(30(31)35)39-22(3)4)40-29(36)18-16-26-13-11-10-12-14-26/h10-16,18-19,25,27-28,30-32H,1,3,17,20H2,2,4-9H3/b18-16+,23-15-,24-19+/t25-,27-,28+,30-,31-,32-,35+/m0/s1

UniChem compound ID

1 reference

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