(Q949595)

inferred from SMILES

mass

622.480854±0 dalton

1 reference

(2R)-4-[(2S,13S)-2,13-dihydroxy-13-[(2S,5S)-5-[(2S,5S)-5-[(1R)-1-hydroxyundecyl]oxolan-2-yl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one

Bullatacin (English)

21 September 2016

1 reference

1 reference

(2R)-4-[(2S,13R)-2,13-dihydroxy-13-[(2R,5S)-5-[(2R,5S)-5-[(1S)-1-hydroxyundecyl]oxolan-2-yl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one

1 reference

(2R)-4-[(2S,13R)-2,13-dihydroxy-13-[(2R,5S)-5-[(2S,5R)-5-[(1S)-1-hydroxyundecyl]oxolan-2-yl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one

1 reference

(2R)-4-[(2S,13R)-2,13-dihydroxy-13-[(2R,5R)-5-[(2R,5R)-5-[(1R)-1-hydroxyundecyl]oxolan-2-yl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one

1 reference

1 reference

(2S)-4-[(2R,13R)-2,13-dihydroxy-13-[(2S,5S)-5-[(2S,5S)-5-[(1S)-1-hydroxyundecyl]oxolan-2-yl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one

1 reference

(2R)-4-[(2S,13R)-2,13-dihydroxy-13-[(2R,5R)-5-[(2R,5R)-5-[(1S)-1-hydroxyundecyl]oxolan-2-yl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one

1 reference

1 reference

(2R)-4-[(2S,13S)-2,13-dihydroxy-13-[(2R,5S)-5-[(2R,5S)-5-[(1R)-1-hydroxyundecyl]oxolan-2-yl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one

1 reference

(2R)-4-[(2S,13S)-2,13-dihydroxy-13-[(2R,5S)-5-[(2R,5S)-5-[(1S)-1-hydroxyundecyl]oxolan-2-yl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one

1 reference

1 reference

1 reference

MBABCNBNDNGODA-YNHIWHQRSA-N

1 reference

chemical formula

C₃₇H₆₆O₇

1 reference

Acetogenins from seeds of Annona reticulata

Bullatacin (English)

21 September 2016

CCCCCCCCCCC(C1CCC(O1)C2CCC(O2)C(CCCCCCCCCCC(CC3=CC(OC3=O)C)O)O)O

1 reference

CCCCCCCCCC[C@@H]([C@H]1CC[C@@H](O1)[C@H]2CC[C@@H](O2)[C@@H](CCCCCCCCCC[C@H](CC3=C[C@@H](OC3=O)C)O)O)O

1 reference

1 reference

Annona mucosa

1 reference

Tryptamine derived amides and acetogenins from the seeds of Rollinia mucosa

Annona squamosa

3 references

Nematicidal and antifungal activities of annonaceous acetogenins from Annona squamosa against various plant pathogens

Cytotoxic bistetrahydrofuran annonaceous acetogenins from the seeds of Annona squamosa

Annonaceous Acetogenins from the Seeds of Annona squamosa. Adjacent Bis-tetrahydrofuranic Acetogenins.

Annona cherimolia

1 reference

Tucumanin, a beta-hydroxy-gamma-lactone bistetrahydrofuranic acetogenin from Annona cherimolia, is a potent inhibitor of mitochondrial complex I.

Artemisia carvifolia

1 reference

In vitro trematocidal effects of crude alcoholic extracts of Artemisia annua, A. absinthium, Asimina triloba, and Fumaria officinalis: trematocidal plant alcoholic extracts

Artemisia apiacea

1 reference

In vitro trematocidal effects of crude alcoholic extracts of Artemisia annua, A. absinthium, Asimina triloba, and Fumaria officinalis: trematocidal plant alcoholic extracts

Artemisia caruifolia

1 reference

In vitro trematocidal effects of crude alcoholic extracts of Artemisia annua, A. absinthium, Asimina triloba, and Fumaria officinalis: trematocidal plant alcoholic extracts

Annona cherimola

1 reference

Tucumanin, a beta-hydroxy-gamma-lactone bistetrahydrofuranic acetogenin from Annona cherimolia, is a potent inhibitor of mitochondrial complex I.

Annona muricata

1 reference

New adjacent Bis-tetrahydrofuran Annonaceous acetogenins from Annona muricata

has part(s)

carbon

quantity

37

0 references

hydrogen

quantity

66

0 references

oxygen

quantity

7

0 references

Identifiers

InChI

InChI=1S/C37H66O7/c1-3-4-5-6-7-11-14-17-20-31(39)33-22-24-35(43-33)36-25-23-34(44-36)32(40)21-18-15-12-9-8-10-13-16-19-30(38)27-29-26-28(2)42-37(29)41/h26,28,30-36,38-40H,3-25,27H2,1-2H3/t28-,30 ,31-,32 ,33 ,34 ,35 ,36 /m0/s1

0 references

InChIKey

1 reference

ChEBI release 2020-09-01

1 reference

1 reference

2 references

https://commonchemistry.cas.org/detail?cas_rn=123123-32-0

10 April 2021

1 reference

3-{2,13-Dihydroxy-13-[5'-(1-hydroxyundecyl)octahydro-2,2'-bifuran-5-yl]tridecyl}-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

( )-Bullatacin (English)

21 September 2016

1 reference

(5S)-3-[(2S,13R)-2,13-Dihydroxy-13-{(2R,2'R,5R,5'R)-5'-[(1R)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

3-[(2S,13S)-2,13-Dihydroxy-13-{(2S,2'S,5S,5'S)-5'-[(1R)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

Asimicin (English)

21 September 2016

1 reference

(5S)-3-[(2R,13R)-2,13-Dihydroxy-13-{(2S,2'S,5R,5'R)-5'-[(1S)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

(5S)-3-[(2R,13R)-2,13-Dihydroxy-13-{(2R,2'S,5R,5'R)-5'-[(1R)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

3-[(13R)-2,13-Dihydroxy-13-{(5R,5'R)-5'-[(1S)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

3-[(13S)-2,13-Dihydroxy-13-{(2S,2'S,5S,5'S)-5'-[(1R)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

(5R)-3-[(2S,13S)-2,13-Dihydroxy-13-{(2S,2'S,5S,5'S)-5'-[(1R)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

(5S)-3-[(2R,13R)-2,13-Dihydroxy-13-{(2S,2'S,5R,5'S)-5'-[(1R)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

(5S)-3-[(2R,13R)-2,13-Dihydroxy-13-{(2S,2'S,5S,5'R)-5'-[(1R)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

(5S)-3-[(2R,13S)-2,13-Dihydroxy-13-{(2R,2'R,5R,5'R)-5'-[(1R)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

(5S)-3-[(13R)-2,13-Dihydroxy-13-{(2R,2'S,5R,5'R)-5'-[(1S)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

(5S)-3-[(13R)-2,13-Dihydroxy-13-{(2R,2'R,5R,5'R)-5'-[(1S)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

(5R)-3-[(2S,13S)-2,13-Dihydroxy-13-{(2R,2'R,5'S)-5'-[(1R)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

(5S)-3-[(2R,13R)-2,13-Dihydroxy-13-{(2R,2'R,5'R)-5'-[(1S)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

3-[(13R)-2,13-Dihydroxy-13-{(2R,2'R,5R,5'R)-5'-[(1R)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

3-[(2R,13R)-2,13-Dihydroxy-13-{(2R,2'R,5R,5'R)-5'-[(1R)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

3-[(13S)-2,13-Dihydroxy-13-{(2R,2'S,5S,5'R)-5'-[(1S)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

3-[(13R)-2,13-Dihydroxy-13-{(2R,2'R,5R,5'R)-5'-[(1S)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

(5R)-3-[(2S,13R)-2,13-Dihydroxy-13-{(2S,2'S,5S,5'S)-5'-[(1S)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

(5R)-3-[(2R,13R)-2,13-Dihydroxy-13-{(2S,2'S,5R,5'R)-5'-[(1S)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

(5R)-3-[(2S,13S)-2,13-Dihydroxy-13-{(2R,2'R,5S,5'S)-5'-[(1R)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

(5S)-3-[(2R,13R)-2,13-Dihydroxy-13-{(2S,2'S,5R,5'R)-5'-[(1R)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

(5S)-3-[(2R,13S)-2,13-Dihydroxy-13-{(2S,2'S,5R,5'R)-5'-[(1S)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

3-[(13S)-2,13-Dihydroxy-13-{(2R,2'R,5S,5'S)-5'-[(1R)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

(5S)-3-[(2R,13S)-2,13-Dihydroxy-13-{(2R,2'R,5R,5'R)-5'-[(1S)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

(5S)-3-[(2R,13S)-2,13-Dihydroxy-13-{(2S,2'S,5R,5'R)-5'-[(1R)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

3-(2,13-Dihydroxy-13-{(2S,2'S,5R)-5'-[(1S)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl)-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

(5R)-3-[(2R,13S)-2,13-Dihydroxy-13-{(2S,2'S,5S,5'S)-5'-[(1R)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

3-{2,13-Dihydroxy-13-[5'-(1-hydroxyundecyl)octahydro-2,2'-bifuran-5-yl]tridecyl}-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

3-[(2S,13S)-2,13-Dihydroxy-13-{(2S,2'S,5S,5'S)-5'-[(1S)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

1 reference

matched by identifier from

(5S)-3-[(2R,13R)-2,13-Dihydroxy-13-{(2S,2'S)-5'-[(1S)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}tridecyl]-5-methyl-2(5H)-furanone (English)

21 September 2016

2 references

7 May 2024

InChIKey

ChEBI ID

68972

mapping relation type

exact match

3 references

ChEBI release 2019-10-02

matched by identifier from

ChEBI release 2021-03-01

International Chemical Identifier

InChI

InChI=1S/C37H66O7/c1-3-4-5-6-7-11-14-17-20-31(39)33-22-24-35(43-33)36-25-23-34(44-36)32(40)21-18-15-12-9-8-10-13-16-19-30(38)27-29-26-28(2)42-37(29)41/h26,28,30-36,38-40H,3-25,27H2,1-2H3/t28-,30 ,31-,32 ,33 ,34 ,35 ,36 /m0/s1

1 reference

1 reference

matched by identifier from

InChIKey