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Compound Summary

Compound Information

acarbose

Compound Name:	acarbose
Compound CID:	41774
Synonyms:	acarbose 56180-94-0 Glucobay Precose Acarbosum More...
Iupac Name:	(3R,4R,5S,6R)-5-[(2R,3R,4R,5S,6R)-5-[(2R,3R,4S,5S,6R)-3,4-dihydroxy-6-methyl-5-[[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino]oxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)oxane-2,3,4-triol
InChI:	InChI=1S/C25H43NO18/c1-6-11(26-8-2-7(3-27)12(30)15(33)13(8)31)14(32)19(37)24(40-6)43-22-10(5-29)42-25(20(38)17(22)35)44-21-9(4-28)41-23(39)18(36)16(21)34/h2,6,8-39H,3-5H2,1H3/t6-,8+,9-,10-,11-,12-,13+,14+,15+,16-,17-,18-,19-,20-,21-,22-,23?,24-,25-/m1/s1
InChIKey:	XUFXOAAUWZOOIT-UGEKTDRHSA-N
Canonical Smiles:	CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OC3C(OC(C(C3O)O)O)CO)CO)O)O)NC4C=C(C(C(C4O)O)O)CO
Isomeric Smiles:	C[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@H]2[C@H](O[C@@H]([C@@H]([C@H]2O)O)O[C@@H]3[C@H](OC([C@@H]([C@H]3O)O)O)CO)CO)O)O)N[C@H]4C=C([C@H]([C@@H]([C@H]4O)O)O)CO
Molecular Weight:	645.6
Molecular Formula:	C25H43NO18

Compound Structure

2D Structure:

3D Structure:

Computed Properties

acarbose

Molecular Weight:	645.6
Molecular Formula:	C25H43NO18
Hydrogen Bond Donor Count:	14
Hydrogen Bond Acceptor Count:	19
Rotatable Bond Count:	9
Heavy Atom Count:	44
Complexity:	962

Synonyms

acarbose

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acarbose	acarbose
(3R,4R,5S,6R)-5-(2R,3R,4R,5S,6R)-5-(2R,3R,4S,5S,6R)-3,4-dihydroxy-6-methyl-5-(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-ylaminooxan-2-yloxy-3,4-dihydroxy-6-(hydroxymethyl)o	(3R,4R,5S,6R)-5-{(2R,3R,4R,5S,6R)-5-{(2R,3R,4S,5S,6R)-3,4-dihydroxy-6-methyl-5-{(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-ylamino}oxan-2-yloxy}-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yloxy}-6-(hydroxymethyl)oxane-2,3,4-triol
180A940	Q-200574
4	6"-Dideoxy-4"-(1S-1,4,6/5-4,5,6-trihydroxy-3-hydroxymethyl-2-yclohexenylamino)-maltotriose
4,6-dideoxy-4-{(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-ylamino}-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-D-glucopyranose; Precose (TN);	WURCS=2.0/3,3,2/a2122h-1x_1-5a2122h-1a_1-5a2122m-1a_1-5_4*NC^SC^SC^SC^RCCO/7=^ZC$3/6O/5O/4O/1-2-3/a4-b1_b4-c1
AB00639959_08	Abamectin, Antibiotic for Culture Media Use Only

Showing 1 to 5 of 33 entries

Experimental Data

acarbose

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Species	Dosage	Unit	CG Lifespan(AVG/MED days)	TG Lifespan(AVG/MED days)	Lifespan Change(AVG/MED%)	CG Lifespan(MAX days)	TG Lifespan(MAX days)	Lifespan Change(MAX%)	Significant	Strain	Gender	PubMed	Active Label

Species	Dosage	Unit	CG Lifespan(AVG/MED days)	TG Lifespan(AVG/MED days)	Lifespan Change(AVG/MED%)	CG Lifespan(MAX days)	TG Lifespan(MAX days)	Lifespan Change(MAX%)	Significant	Strain	Gender	PubMed	Active Label
Mus musculus	1000	mg/kg	925	999	8	1051	1219	0.16	S	UM	MALES	24245565	Active
Mus musculus	1000	mg/kg	807	974	21	1061	1212	0.14	S	TJL	MALES	24245565	Active
Mus musculus	1000	ppm	887	902	2	1100	1166	6	NS	C2012	FEMALES	27312235	Inactive
Mus musculus	1000	ppm	823	875	6	1055	1183	12	S	C2012	MALES	27312235	Active
Mus musculus	1000	mg/kg	887	949	7	1089	1152	0.06	NS	UM	FEMALES	24245565	Inactive
Mus musculus	1000	mg/kg	864	942	9	1062	1167	0.1	S	UT	FEMALES	24245565	Active
Mus musculus	1000	mg/kg	918	911	-1	1084	1148	0.06	NS	TJL	FEMALES	24245565	Inactive
Mus musculus	1000	mg/kg	704	981	39	1013	1204	0.19	S	UT	MALES	24245565	Active

Showing 1 to 8 of 8 entries

Experimental Data Visualization

acarbose

Statistics Data

acarbose

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Species	Lifespan Change(AVG/MED%)	Lifespan Change(MAX%)	Count Reference	Count Data point
Mus musculus	39	12	2	8

Showing 1 to 1 of 1 entries

Statistics Data Visualization

acarbose

Compound Name:

acarbose

Compound CID:

41774

Synonyms:

acarbose 56180-94-0 Glucobay Precose Acarbosum More...

Iupac Name:

(3R,4R,5S,6R)-5-[(2R,3R,4R,5S,6R)-5-[(2R,3R,4S,5S,6R)-3,4-dihydroxy-6-methyl-5-[[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino]oxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)oxane-2,3,4-triol

InChI:

InChI=1S/C25H43NO18/c1-6-11(26-8-2-7(3-27)12(30)15(33)13(8)31)14(32)19(37)24(40-6)43-22-10(5-29)42-25(20(38)17(22)35)44-21-9(4-28)41-23(39)18(36)16(21)34/h2,6,8-39H,3-5H2,1H3/t6-,8+,9-,10-,11-,12-,13+,14+,15+,16-,17-,18-,19-,20-,21-,22-,23?,24-,25-/m1/s1

InChIKey:

XUFXOAAUWZOOIT-UGEKTDRHSA-N

Canonical Smiles:

CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OC3C(OC(C(C3O)O)O)CO)CO)O)O)NC4C=C(C(C(C4O)O)O)CO

Isomeric Smiles:

C[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@H]2[C@H](O[C@@H]([C@@H]([C@H]2O)O)O[C@@H]3[C@H](OC([C@@H]([C@H]3O)O)O)CO)CO)O)O)N[C@H]4C=C([C@H]([C@@H]([C@H]4O)O)O)CO

Molecular Weight:

645.6

Molecular Formula:

C25H43NO18

Molecular Weight:

645.6

Molecular Formula:

C25H43NO18

Hydrogen Bond Donor Count:

14

Hydrogen Bond Acceptor Count:

19

Rotatable Bond Count:

9

Heavy Atom Count:

44

Complexity:

962

(3R,4R,5S,6R)-5-(2R,3R,4R,5S,6R)-5-(2R,3R,4S,5S,6R)-3,4-dihydroxy-6-methyl-5-(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-ylaminooxan-2-yloxy-3,4-dihydroxy-6-(hydroxymethyl)o

(3R,4R,5S,6R)-5-{(2R,3R,4R,5S,6R)-5-{(2R,3R,4S,5S,6R)-3,4-dihydroxy-6-methyl-5-{(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-ylamino}oxan-2-yloxy}-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yloxy}-6-(hydroxymethyl)oxane-2,3,4-triol

180A940

Q-200574

4

6"-Dideoxy-4"-(1S-1,4,6/5-4,5,6-trihydroxy-3-hydroxymethyl-2-yclohexenylamino)-maltotriose

4,6-dideoxy-4-{(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-ylamino}-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-D-glucopyranose; Precose (TN);

WURCS=2.0/3,3,2/a2122h-1x_1-5a2122h-1a_1-5a2122m-1a_1-5_4*NC^SC^SC^SC^RCCO/7=^ZC$3/6O/5O/4O/1-2-3/a4-b1_b4-c1

AB00639959_08

Abamectin, Antibiotic for Culture Media Use Only

acarbose

56180-94-0

Glucobay

Precose

Acarbosum

More...