[6-[6-[2-[6-[3-[benzyl(phenylmethoxycarbonyl)amino]propoxy]-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-4-yl]oxy-5-(1,3-dioxoisoindol-2-yl)-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-8-[3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] benzoate

C154H154N2O30 — CID 177437233

IUPAC[6-[6-[2-[6-[3-[benzyl(phenylmethoxycarbonyl)amino]propoxy]-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-4-yl]oxy-5-(1,3-dioxoisoindol-2-yl)-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-8-[3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] benzoate
SMILESO=C(OC1C(OC2C(COCc3ccccc3)OC(OC3C(OCc4ccccc4)C(COCc4ccccc4)OC(OC4C(COCc5ccccc5)OC(OCCCN(Cc5ccccc5)C(=O)OCc5ccccc5)C(OCc5ccccc5)C4OCc4ccccc4)C3OCc3ccccc3)C(N3C(=O)c4ccccc4C3=O)C2OCc2ccccc2)OC2COC(c3ccccc3)OC2C1OC1OC(COCc2ccccc2)C(OCc2ccccc2)C(OCc2ccccc2)C1OCc1ccccc1)c1ccccc1
InChIInChI=1S/C154H154N2O30/c157-145-123-84-49-50-85-124(123)146(158)156(145)130-136(168-95-114-66-31-8-32-67-114)133(183-153-144(181-147(159)121-80-45-15-46-81-121)140(135-129(180-153)106-174-148(182-135)122-82-47-16-48-83-122)186-151-142(172-99-118-74-39-12-40-75-118)137(169-96-115-68-33-9-34-69-115)131(166-93-112-62-27-6-28-63-112)125(178-151)102-161-89-108-54-19-2-20-55-108)127(104-163-91-110-58-23-4-24-59-110)176-149(130)185-139-132(167-94-113-64-29-7-30-65-113)126(103-162-90-109-56-21-3-22-57-109)179-152(143(139)173-100-119-76-41-13-42-77-119)184-134-128(105-164-92-111-60-25-5-26-61-111)177-150(141(171-98-117-72-37-11-38-73-117)138(134)170-97-116-70-35-10-36-71-116)165-87-51-86-155(88-107-52-17-1-18-53-107)154(160)175-101-120-78-43-14-44-79-120/h1-50,52-85,125-144,148-153H,51,86-106H2
InChIKeyMXBXEPXZQWBCQO-UHFFFAOYSA-N
MW2512.91 g/mol
LogP24.95
Rot. Bonds61

About [6-[6-[2-[6-[3-[benzyl(phenylmethoxycarbonyl)amino]propoxy]-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-4-yl]oxy-5-(1,3-dioxoisoindol-2-yl)-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-8-[3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] benzoate

[6-[6-[2-[6-[3-[benzyl(phenylmethoxycarbonyl)amino]propoxy]-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-4-yl]oxy-5-(1,3-dioxoisoindol-2-yl)-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-8-[3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] benzoate (PubChem CID 177437233) has the molecular formula C154H154N2O30 and a molecular weight of 2512.91 g/mol. Its IUPAC name is [6-[6-[2-[6-[3-[benzyl(phenylmethoxycarbonyl)amino]propoxy]-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-4-yl]oxy-5-(1,3-dioxoisoindol-2-yl)-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-8-[3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] benzoate.

Molecular Properties

Compound Name[6-[6-[2-[6-[3-[benzyl(phenylmethoxycarbonyl)amino]propoxy]-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-4-yl]oxy-5-(1,3-dioxoisoindol-2-yl)-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-8-[3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] benzoate
PubChem CID177437233
Molecular FormulaC154H154N2O30
Molecular Weight2512.91 g/mol
Exact Mass2511.06
IUPAC Name[6-[6-[2-[6-[3-[benzyl(phenylmethoxycarbonyl)amino]propoxy]-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-4-yl]oxy-5-(1,3-dioxoisoindol-2-yl)-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-8-[3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] benzoate
SMILESO=C(OC1C(OC2C(COCc3ccccc3)OC(OC3C(OCc4ccccc4)C(COCc4ccccc4)OC(OC4C(COCc5ccccc5)OC(OCCCN(Cc5ccccc5)C(=O)OCc5ccccc5)C(OCc5ccccc5)C4OCc4ccccc4)C3OCc3ccccc3)C(N3C(=O)c4ccccc4C3=O)C2OCc2ccccc2)OC2COC(c3ccccc3)OC2C1OC1OC(COCc2ccccc2)C(OCc2ccccc2)C(OCc2ccccc2)C1OCc1ccccc1)c1ccccc1
InChIInChI=1S/C154H154N2O30/c157-145-123-84-49-50-85-124(123)146(158)156(145)130-136(168-95-114-66-31-8-32-67-114)133(183-153-144(181-147(159)121-80-45-15-46-81-121)140(135-129(180-153)106-174-148(182-135)122-82-47-16-48-83-122)186-151-142(172-99-118-74-39-12-40-75-118)137(169-96-115-68-33-9-34-69-115)131(166-93-112-62-27-6-28-63-112)125(178-151)102-161-89-108-54-19-2-20-55-108)127(104-163-91-110-58-23-4-24-59-110)176-149(130)185-139-132(167-94-113-64-29-7-30-65-113)126(103-162-90-109-56-21-3-22-57-109)179-152(143(139)173-100-119-76-41-13-42-77-119)184-134-128(105-164-92-111-60-25-5-26-61-111)177-150(141(171-98-117-72-37-11-38-73-117)138(134)170-97-116-70-35-10-36-71-116)165-87-51-86-155(88-107-52-17-1-18-53-107)154(160)175-101-120-78-43-14-44-79-120/h1-50,52-85,125-144,148-153H,51,86-106H2
InChIKeyMXBXEPXZQWBCQO-UHFFFAOYSA-N
XLogP24.95
TPSA314.74 Ų
H-Bond Donors
H-Bond Acceptors30
Rotatable Bonds61
Heavy Atoms186
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002512.91
LogP ≤ 524.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze [6-[6-[2-[6-[3-[benzyl(phenylmethoxycarbonyl)amino]propoxy]-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-4-yl]oxy-5-(1,3-dioxoisoindol-2-yl)-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-8-[3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] benzoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[(4aR,6S,7R,8S,8aS)-6-[(2R,3S,4R,5R,6R)-5-(1,3-dioxoisoindol-2-yl)-4-phenylmethoxy-6-[3-(phenylmethoxycarbonylamino)propoxy]-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-8-[(2R,3R,4S,5S,6R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] benzoate
CID 177489217
[(2S,4aR,6S,7R,8S,8aS)-6-[(2R,3S,4R,5R,6S)-6-[(2S,3R,4S,5S,6R)-2-[(2R,3R,4S,5R,6R)-6-(3-azidopropoxy)-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-4-yl]oxy-5-(1,3-dioxoisoindol-2-yl)-4-[(2S,3S,4R,5R,6S)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-7-benzoyloxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl] benzoate
CID 23659542
benzyl N-[5-[(2R,5R)-5-[(2S,5S)-5-[[(6R,8aR)-8-hydroxy-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-3,4-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxypentyl]-N-benzylcarbamate
CID 131980776
[(2R,3S,4S,5R,6R)-6-[[(2R,4aR,6R,7R,8R,8aS)-7-(1,3-dioxoisoindol-2-yl)-2-phenyl-6-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl]oxy]-3,4,5-tribenzoyloxyoxan-2-yl]methyl benzoate
CID 10866044
[(2R,3R,4R,5R,6R)-2-[[(4aR,6S,7R,8R,8aR)-7-(1,3-dioxoisoindol-2-yl)-6-[(2R,3R,4S,5R,6R)-6-methoxy-2-[(4-methoxyphenyl)methoxymethyl]-4,5-bis(phenylmethoxy)oxan-3-yl]oxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl]oxy]-5-[tert-butyl(dimethyl)silyl]oxy-6-[(4-methoxyphenyl)methoxymethyl]-4-phenylmethoxyoxan-3-yl] benzoate
CID 102414199
benzyl N-[6-[[(4aR,6R,7R,8S,8aS)-2-phenyl-7,8-bis(phenylmethoxy)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]hexyl]-N-benzylcarbamate
CID 10985588
[(2S,3R,4S,5R,6R)-5-[(2S,3S,4S,5R,6R)-5-[[(2R,4aR,6S,7S,8S,8aR)-2-phenyl-7,8-bis(phenylmethoxy)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-3,4-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-2-[(2R,3R,4S,5S,6S)-6-[(2R,3R,4S,5S,6S)-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-6-[(2R,3R,4S,5S,6S)-4,5,6-tris(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-5-[(4-methoxyphenyl)methoxy]-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4-phenylmethoxy-6-(phenylmethoxymethyl)oxan-3-yl] benzoate
CID 71761998
[(4aR,6R,7S,8S,8aS)-8-acetylsulfanyl-6-[(2R,3R,4R,5S,6R)-3-(1,3-dioxoisoindol-2-yl)-2-methoxy-6-(phenylmethoxymethyl)-5-[(2S,3S,4R,5R)-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxyoxan-4-yl]oxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] benzoate
CID 101493938
[(2R,3S,4S,5R,6R)-6-[[(2R,4aR,6S,7R,8R,8aS)-7-(3,4-dimethyl-2,5-dioxopyrrol-1-yl)-2-phenyl-6-[(2R,3R,4S,5R,6R)-4,5,6-tris(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl]oxy]-3,4,5-triacetyloxyoxan-2-yl]methyl acetate
CID 10630184
[(6R,8S,8aS)-6-[(3S,4S,6R)-5-benzoyloxy-6-[2-[benzyl(phenylmethoxycarbonyl)amino]ethoxy]-2-ethyl-4-methyloxan-3-yl]oxy-8-methyl-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] benzoate
CID 122579206
[(2R,4aR,6S,7S,8S,8aR)-7-acetyloxy-6-[(2R,3S,4R,5R,6S)-6-[(2R,3S,4R,5R,6R)-6-azido-5-(1,3-dioxoisoindol-2-yl)-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-5-(1,3-dioxoisoindol-2-yl)-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl] acetate
CID 10964320
[(2R,3S,4S,5R,6S)-4-[(2S,3R,4R,5S,6R)-5-[[(4aR,6S,7R,8S,8aS)-7,8-diacetyloxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-3-(1,3-dioxoisoindol-2-yl)-4-hydroxy-6-(phenylmethoxymethyl)oxan-2-yl]oxy-6-[(2R,3R,4S,5R,6S)-6-(4-methoxyphenoxy)-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-5-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl] acetate
CID 102396029

Frequently Asked Questions

What is the IUPAC name of [6-[6-[2-[6-[3-[benzyl(phenylmethoxycarbonyl)amino]propoxy]-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-4-yl]oxy-5-(1,3-dioxoisoindol-2-yl)-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-8-[3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] benzoate?
The IUPAC name of [6-[6-[2-[6-[3-[benzyl(phenylmethoxycarbonyl)amino]propoxy]-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-4-yl]oxy-5-(1,3-dioxoisoindol-2-yl)-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-8-[3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] benzoate (CID 177437233) is [6-[6-[2-[6-[3-[benzyl(phenylmethoxycarbonyl)amino]propoxy]-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-4-yl]oxy-5-(1,3-dioxoisoindol-2-yl)-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-8-[3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] benzoate.
What is the SMILES notation for [6-[6-[2-[6-[3-[benzyl(phenylmethoxycarbonyl)amino]propoxy]-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-4-yl]oxy-5-(1,3-dioxoisoindol-2-yl)-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-8-[3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] benzoate?
The canonical SMILES for [6-[6-[2-[6-[3-[benzyl(phenylmethoxycarbonyl)amino]propoxy]-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-4-yl]oxy-5-(1,3-dioxoisoindol-2-yl)-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-8-[3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] benzoate is O=C(OC1C(OC2C(COCc3ccccc3)OC(OC3C(OCc4ccccc4)C(COCc4ccccc4)OC(OC4C(COCc5ccccc5)OC(OCCCN(Cc5ccccc5)C(=O)OCc5ccccc5)C(OCc5ccccc5)C4OCc4ccccc4)C3OCc3ccccc3)C(N3C(=O)c4ccccc4C3=O)C2OCc2ccccc2)OC2COC(c3ccccc3)OC2C1OC1OC(COCc2ccccc2)C(OCc2ccccc2)C(OCc2ccccc2)C1OCc1ccccc1)c1ccccc1.
What is the InChIKey of [6-[6-[2-[6-[3-[benzyl(phenylmethoxycarbonyl)amino]propoxy]-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-4-yl]oxy-5-(1,3-dioxoisoindol-2-yl)-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-8-[3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] benzoate?
The InChIKey is MXBXEPXZQWBCQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C154H154N2O30/c157-145-123-84-49-50-85-124(123)146(158)156(145)130-136(168-95-114-66-31-8-32-67-114)133(183-153-144(181-147(159)121-80-45-15-46-81-121)140(135-129(180-153)106-174-148(182-135)122-82-47-16-48-83-122)186-151-142(172-99-118-74-39-12-40-75-118)137(169-96-115-68-33-9-34-69-115)131(166-93-112-62-27-6-28-63-112)125(178-151)102-161-89-108-54-19-2-20-55-108)127(104-163-91-110-58-23-4-24-59-110)176-149(130)185-139-132(167-94-113-64-29-7-30-65-113)126(103-162-90-109-56-21-3-22-57-109)179-152(143(139)173-100-119-76-41-13-42-77-119)184-134-128(105-164-92-111-60-25-5-26-61-111)177-150(141(171-98-117-72-37-11-38-73-117)138(134)170-97-116-70-35-10-36-71-116)165-87-51-86-155(88-107-52-17-1-18-53-107)154(160)175-101-120-78-43-14-44-79-120/h1-50,52-85,125-144,148-153H,51,86-106H2.
What are the key properties of [6-[6-[2-[6-[3-[benzyl(phenylmethoxycarbonyl)amino]propoxy]-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-4-yl]oxy-5-(1,3-dioxoisoindol-2-yl)-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-8-[3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] benzoate?
[6-[6-[2-[6-[3-[benzyl(phenylmethoxycarbonyl)amino]propoxy]-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-4-yl]oxy-5-(1,3-dioxoisoindol-2-yl)-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-8-[3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] benzoate has a molecular weight of 2512.91 g/mol, XLogP of 24.95, 61 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[6-[2-[6-[3-[benzyl(phenylmethoxycarbonyl)amino]propoxy]-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-3,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-4-yl]oxy-5-(1,3-dioxoisoindol-2-yl)-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-8-[3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] benzoate is sourced from PubChem (CID 177437233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).