5-[[3-[[3-[[3,5-bis[[3,5-bis[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenyl]methoxy]phenoxy]methyl]-5-[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenoxy]methyl]-5-[(3,5-dihydroxyphenyl)methoxy]phenoxy]methyl]benzene-1,3-diol

C153H132O45 — CID 58912216

IUPAC5-[[3-[[3-[[3,5-bis[[3,5-bis[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenyl]methoxy]phenoxy]methyl]-5-[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenoxy]methyl]-5-[(3,5-dihydroxyphenyl)methoxy]phenoxy]methyl]benzene-1,3-diol
SMILESOc1cc(O)cc(COc2cc(COc3cc(COc4cc(OCc5cc(OCc6cc(OCc7cc(O)cc(O)c7)cc(OCc7cc(O)cc(O)c7)c6)cc(OCc6cc(OCc7cc(O)cc(O)c7)cc(OCc7cc(O)cc(O)c7)c6)c5)cc(OCc5cc(OCc6cc(OCc7cc(O)cc(O)c7)cc(OCc7cc(O)cc(O)c7)c6)cc(OCc6cc(OCc7cc(O)cc(O)c7)cc(OCc7cc(O)cc(O)c7)c6)c5)c4)cc(OCc4cc(OCc5cc(O)cc(O)c5)cc(OCc5cc(O)cc(O)c5)c4)c3)cc(OCc3cc(O)cc(O)c3)c2)c1
InChIInChI=1S/C153H132O45/c154-109-1-88(2-110(155)43-109)67-178-133-25-100(26-134(55-133)179-68-89-3-111(156)44-112(157)4-89)79-190-145-37-106(38-146(61-145)191-80-101-27-135(180-69-90-5-113(158)45-114(159)6-90)56-136(28-101)181-70-91-7-115(160)46-116(161)8-91)85-196-151-64-152(197-86-107-39-147(192-81-102-29-137(182-71-92-9-117(162)47-118(163)10-92)57-138(30-102)183-72-93-11-119(164)48-120(165)12-93)62-148(40-107)193-82-103-31-139(184-73-94-13-121(166)49-122(167)14-94)58-140(32-103)185-74-95-15-123(168)50-124(169)16-95)66-153(65-151)198-87-108-41-149(194-83-104-33-141(186-75-96-17-125(170)51-126(171)18-96)59-142(34-104)187-76-97-19-127(172)52-128(173)20-97)63-150(42-108)195-84-105-35-143(188-77-98-21-129(174)53-130(175)22-98)60-144(36-105)189-78-99-23-131(176)54-132(177)24-99/h1-66,154-177H,67-87H2
InChIKeyBYAIWJZRYVATSP-UHFFFAOYSA-N
MW2690.69 g/mol
LogP27.78
Rot. Bonds63

About 5-[[3-[[3-[[3,5-bis[[3,5-bis[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenyl]methoxy]phenoxy]methyl]-5-[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenoxy]methyl]-5-[(3,5-dihydroxyphenyl)methoxy]phenoxy]methyl]benzene-1,3-diol

5-[[3-[[3-[[3,5-bis[[3,5-bis[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenyl]methoxy]phenoxy]methyl]-5-[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenoxy]methyl]-5-[(3,5-dihydroxyphenyl)methoxy]phenoxy]methyl]benzene-1,3-diol (PubChem CID 58912216) has the molecular formula C153H132O45 and a molecular weight of 2690.69 g/mol. Its IUPAC name is 5-[[3-[[3-[[3,5-bis[[3,5-bis[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenyl]methoxy]phenoxy]methyl]-5-[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenoxy]methyl]-5-[(3,5-dihydroxyphenyl)methoxy]phenoxy]methyl]benzene-1,3-diol.

Molecular Properties

Compound Name5-[[3-[[3-[[3,5-bis[[3,5-bis[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenyl]methoxy]phenoxy]methyl]-5-[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenoxy]methyl]-5-[(3,5-dihydroxyphenyl)methoxy]phenoxy]methyl]benzene-1,3-diol
PubChem CID58912216
Molecular FormulaC153H132O45
Molecular Weight2690.69 g/mol
Exact Mass2688.80
IUPAC Name5-[[3-[[3-[[3,5-bis[[3,5-bis[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenyl]methoxy]phenoxy]methyl]-5-[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenoxy]methyl]-5-[(3,5-dihydroxyphenyl)methoxy]phenoxy]methyl]benzene-1,3-diol
SMILESOc1cc(O)cc(COc2cc(COc3cc(COc4cc(OCc5cc(OCc6cc(OCc7cc(O)cc(O)c7)cc(OCc7cc(O)cc(O)c7)c6)cc(OCc6cc(OCc7cc(O)cc(O)c7)cc(OCc7cc(O)cc(O)c7)c6)c5)cc(OCc5cc(OCc6cc(OCc7cc(O)cc(O)c7)cc(OCc7cc(O)cc(O)c7)c6)cc(OCc6cc(OCc7cc(O)cc(O)c7)cc(OCc7cc(O)cc(O)c7)c6)c5)c4)cc(OCc4cc(OCc5cc(O)cc(O)c5)cc(OCc5cc(O)cc(O)c5)c4)c3)cc(OCc3cc(O)cc(O)c3)c2)c1
InChIInChI=1S/C153H132O45/c154-109-1-88(2-110(155)43-109)67-178-133-25-100(26-134(55-133)179-68-89-3-111(156)44-112(157)4-89)79-190-145-37-106(38-146(61-145)191-80-101-27-135(180-69-90-5-113(158)45-114(159)6-90)56-136(28-101)181-70-91-7-115(160)46-116(161)8-91)85-196-151-64-152(197-86-107-39-147(192-81-102-29-137(182-71-92-9-117(162)47-118(163)10-92)57-138(30-102)183-72-93-11-119(164)48-120(165)12-93)62-148(40-107)193-82-103-31-139(184-73-94-13-121(166)49-122(167)14-94)58-140(32-103)185-74-95-15-123(168)50-124(169)16-95)66-153(65-151)198-87-108-41-149(194-83-104-33-141(186-75-96-17-125(170)51-126(171)18-96)59-142(34-104)187-76-97-19-127(172)52-128(173)20-97)63-150(42-108)195-84-105-35-143(188-77-98-21-129(174)53-130(175)22-98)60-144(36-105)189-78-99-23-131(176)54-132(177)24-99/h1-66,154-177H,67-87H2
InChIKeyBYAIWJZRYVATSP-UHFFFAOYSA-N
XLogP27.78
TPSA679.35 Ų
H-Bond Donors24
H-Bond Acceptors45
Rotatable Bonds63
Heavy Atoms198
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002690.69
LogP ≤ 527.78
H-Bond Donors ≤ 524
H-Bond Acceptors ≤ 1045

Analyze 5-[[3-[[3-[[3,5-bis[[3,5-bis[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenyl]methoxy]phenoxy]methyl]-5-[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenoxy]methyl]-5-[(3,5-dihydroxyphenyl)methoxy]phenoxy]methyl]benzene-1,3-diol with MolForge

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Related Compounds

3,5-bis[(3,5-dimethoxyphenyl)methoxy]phenol
CID 54586280
5-[[3-[(3,5-dihydroxyphenyl)methoxy]-5-[[3-[[3-[(3,5-dihydroxyphenyl)methoxy]-5-[(3-hydroxy-5-methylphenyl)methoxy]phenyl]methoxy]-5-[(4-methylphenoxy)methyl]phenoxy]methyl]phenoxy]methyl]benzene-1,3-diol
CID 58912218
5-[2-[3-[[3-[[3-[[3-[[3-[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]-5-hydroxyphenyl]methoxy]-5-[[3-[(3,5-dihydroxyphenyl)methoxy]-5-hydroxyphenyl]methoxy]phenyl]methoxy]-5-(methoxymethyl)phenoxy]methyl]-5-hydroxyphenoxy]methyl]-5-hydroxyphenoxy]ethyl]benzene-1,3-diol
CID 59939789
3-[[3-[[3-[[3-(hydroxymethyl)-5-phenylmethoxyphenoxy]methyl]-5-phenylmethoxyphenoxy]methyl]-5-phenylmethoxyphenoxy]methyl]-5-phenylmethoxyphenol
CID 101175071
[3-[[3,5-bis[[3,5-bis(hydroxymethyl)phenyl]methoxy]phenoxy]methyl]-5-(hydroxymethyl)phenyl]methanol
CID 101251807
3-[(3,5-dimethylphenoxy)methyl]-5-methoxyphenol
CID 70951574
5-[4-[3,5-bis[4-(3,5-dihydroxyphenoxy)butoxy]phenoxy]butoxy]benzene-1,3-diol
CID 53305209
[3,5-bis[[3,5-bis[(3,5-dimethoxyphenyl)methoxy]phenyl]methoxy]phenyl]methanol
CID 101100720
[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methanol
CID 15385707
3-[(4-tert-butylphenyl)methoxy]-5-(hydroxymethyl)phenol
CID 101207534
1-[[3-[[3,5-bis[(3,5-dimethylphenyl)methoxy]phenyl]methoxy]-5-ethylphenoxy]methyl]-3,5-bis[(3,5-dimethylphenyl)methoxy]benzene
CID 59710807
3-(2-hydroxyethyl)-5-[(4-methoxyphenyl)methoxy]phenol
CID 143727870

Frequently Asked Questions

What is the IUPAC name of 5-[[3-[[3-[[3,5-bis[[3,5-bis[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenyl]methoxy]phenoxy]methyl]-5-[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenoxy]methyl]-5-[(3,5-dihydroxyphenyl)methoxy]phenoxy]methyl]benzene-1,3-diol?
The IUPAC name of 5-[[3-[[3-[[3,5-bis[[3,5-bis[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenyl]methoxy]phenoxy]methyl]-5-[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenoxy]methyl]-5-[(3,5-dihydroxyphenyl)methoxy]phenoxy]methyl]benzene-1,3-diol (CID 58912216) is 5-[[3-[[3-[[3,5-bis[[3,5-bis[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenyl]methoxy]phenoxy]methyl]-5-[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenoxy]methyl]-5-[(3,5-dihydroxyphenyl)methoxy]phenoxy]methyl]benzene-1,3-diol.
What is the SMILES notation for 5-[[3-[[3-[[3,5-bis[[3,5-bis[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenyl]methoxy]phenoxy]methyl]-5-[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenoxy]methyl]-5-[(3,5-dihydroxyphenyl)methoxy]phenoxy]methyl]benzene-1,3-diol?
The canonical SMILES for 5-[[3-[[3-[[3,5-bis[[3,5-bis[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenyl]methoxy]phenoxy]methyl]-5-[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenoxy]methyl]-5-[(3,5-dihydroxyphenyl)methoxy]phenoxy]methyl]benzene-1,3-diol is Oc1cc(O)cc(COc2cc(COc3cc(COc4cc(OCc5cc(OCc6cc(OCc7cc(O)cc(O)c7)cc(OCc7cc(O)cc(O)c7)c6)cc(OCc6cc(OCc7cc(O)cc(O)c7)cc(OCc7cc(O)cc(O)c7)c6)c5)cc(OCc5cc(OCc6cc(OCc7cc(O)cc(O)c7)cc(OCc7cc(O)cc(O)c7)c6)cc(OCc6cc(OCc7cc(O)cc(O)c7)cc(OCc7cc(O)cc(O)c7)c6)c5)c4)cc(OCc4cc(OCc5cc(O)cc(O)c5)cc(OCc5cc(O)cc(O)c5)c4)c3)cc(OCc3cc(O)cc(O)c3)c2)c1.
What is the InChIKey of 5-[[3-[[3-[[3,5-bis[[3,5-bis[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenyl]methoxy]phenoxy]methyl]-5-[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenoxy]methyl]-5-[(3,5-dihydroxyphenyl)methoxy]phenoxy]methyl]benzene-1,3-diol?
The InChIKey is BYAIWJZRYVATSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C153H132O45/c154-109-1-88(2-110(155)43-109)67-178-133-25-100(26-134(55-133)179-68-89-3-111(156)44-112(157)4-89)79-190-145-37-106(38-146(61-145)191-80-101-27-135(180-69-90-5-113(158)45-114(159)6-90)56-136(28-101)181-70-91-7-115(160)46-116(161)8-91)85-196-151-64-152(197-86-107-39-147(192-81-102-29-137(182-71-92-9-117(162)47-118(163)10-92)57-138(30-102)183-72-93-11-119(164)48-120(165)12-93)62-148(40-107)193-82-103-31-139(184-73-94-13-121(166)49-122(167)14-94)58-140(32-103)185-74-95-15-123(168)50-124(169)16-95)66-153(65-151)198-87-108-41-149(194-83-104-33-141(186-75-96-17-125(170)51-126(171)18-96)59-142(34-104)187-76-97-19-127(172)52-128(173)20-97)63-150(42-108)195-84-105-35-143(188-77-98-21-129(174)53-130(175)22-98)60-144(36-105)189-78-99-23-131(176)54-132(177)24-99/h1-66,154-177H,67-87H2.
What are the key properties of 5-[[3-[[3-[[3,5-bis[[3,5-bis[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenyl]methoxy]phenoxy]methyl]-5-[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenoxy]methyl]-5-[(3,5-dihydroxyphenyl)methoxy]phenoxy]methyl]benzene-1,3-diol?
5-[[3-[[3-[[3,5-bis[[3,5-bis[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenyl]methoxy]phenoxy]methyl]-5-[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenoxy]methyl]-5-[(3,5-dihydroxyphenyl)methoxy]phenoxy]methyl]benzene-1,3-diol has a molecular weight of 2690.69 g/mol, XLogP of 27.78, 63 rotatable bonds, 24 hydrogen bond donors, and 45 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[3-[[3-[[3,5-bis[[3,5-bis[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenyl]methoxy]phenoxy]methyl]-5-[[3,5-bis[(3,5-dihydroxyphenyl)methoxy]phenyl]methoxy]phenoxy]methyl]-5-[(3,5-dihydroxyphenyl)methoxy]phenoxy]methyl]benzene-1,3-diol is sourced from PubChem (CID 58912216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).