[(3R,4R,6S)-6-[[(6R,8S,8aS)-6-[(3S,4R,6S)-6-[(3R,4R,6R)-4,5-bis(phenylmethoxy)-6-[5-(phenylmethoxycarbonylamino)pentoxy]-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl]oxy]-3-benzoyloxy-4-[(2R,4R,5S)-3-[(2S,4S,5R)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;[(3R,4R,6S)-3-benzoyloxy-4-[(2R,4S,5S)-3-hydroxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-6-methyl-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;benzyl N-[5-[(2R,4R,5R)-5-[(2S,4R,5S)-5-[[(6R,8S,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]carbamate;(3R,6R)-2,6-dimethyl-3,4,5-tris(phenylmethoxy)oxane

C330H350Cl6N4O70 — CID 159178513

About [(3R,4R,6S)-6-[[(6R,8S,8aS)-6-[(3S,4R,6S)-6-[(3R,4R,6R)-4,5-bis(phenylmethoxy)-6-[5-(phenylmethoxycarbonylamino)pentoxy]-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl]oxy]-3-benzoyloxy-4-[(2R,4R,5S)-3-[(2S,4S,5R)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;[(3R,4R,6S)-3-benzoyloxy-4-[(2R,4S,5S)-3-hydroxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-6-methyl-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;benzyl N-[5-[(2R,4R,5R)-5-[(2S,4R,5S)-5-[[(6R,8S,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]carbamate;(3R,6R)-2,6-dimethyl-3,4,5-tris(phenylmethoxy)oxane

[(3R,4R,6S)-6-[[(6R,8S,8aS)-6-[(3S,4R,6S)-6-[(3R,4R,6R)-4,5-bis(phenylmethoxy)-6-[5-(phenylmethoxycarbonylamino)pentoxy]-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl]oxy]-3-benzoyloxy-4-[(2R,4R,5S)-3-[(2S,4S,5R)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;[(3R,4R,6S)-3-benzoyloxy-4-[(2R,4S,5S)-3-hydroxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-6-methyl-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;benzyl N-[5-[(2R,4R,5R)-5-[(2S,4R,5S)-5-[[(6R,8S,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]carbamate;(3R,6R)-2,6-dimethyl-3,4,5-tris(phenylmethoxy)oxane (PubChem CID 159178513) has the molecular formula C330H350Cl6N4O70 and a molecular weight of 5705.11 g/mol. Its IUPAC name is [(3R,4R,6S)-6-[[(6R,8S,8aS)-6-[(3S,4R,6S)-6-[(3R,4R,6R)-4,5-bis(phenylmethoxy)-6-[5-(phenylmethoxycarbonylamino)pentoxy]-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl]oxy]-3-benzoyloxy-4-[(2R,4R,5S)-3-[(2S,4S,5R)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;[(3R,4R,6S)-3-benzoyloxy-4-[(2R,4S,5S)-3-hydroxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-6-methyl-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;benzyl N-[5-[(2R,4R,5R)-5-[(2S,4R,5S)-5-[[(6R,8S,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]carbamate;(3R,6R)-2,6-dimethyl-3,4,5-tris(phenylmethoxy)oxane.

Molecular Properties

• Compound Name: [(3R,4R,6S)-6-[[(6R,8S,8aS)-6-[(3S,4R,6S)-6-[(3R,4R,6R)-4,5-bis(phenylmethoxy)-6-[5-(phenylmethoxycarbonylamino)pentoxy]-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl]oxy]-3-benzoyloxy-4-[(2R,4R,5S)-3-[(2S,4S,5R)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;[(3R,4R,6S)-3-benzoyloxy-4-[(2R,4S,5S)-3-hydroxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-6-methyl-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;benzyl N-[5-[(2R,4R,5R)-5-[(2S,4R,5S)-5-[[(6R,8S,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]carbamate;(3R,6R)-2,6-dimethyl-3,4,5-tris(phenylmethoxy)oxane
• PubChem CID: 159178513
• Molecular Formula: C330H350Cl6N4O70
• Molecular Weight: 5705.11 g/mol
• Exact Mass: 5698.21
• IUPAC Name: [(3R,4R,6S)-6-[[(6R,8S,8aS)-6-[(3S,4R,6S)-6-[(3R,4R,6R)-4,5-bis(phenylmethoxy)-6-[5-(phenylmethoxycarbonylamino)pentoxy]-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl]oxy]-3-benzoyloxy-4-[(2R,4R,5S)-3-[(2S,4S,5R)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;[(3R,4R,6S)-3-benzoyloxy-4-[(2R,4S,5S)-3-hydroxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-6-methyl-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;benzyl N-[5-[(2R,4R,5R)-5-[(2S,4R,5S)-5-[[(6R,8S,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]carbamate;(3R,6R)-2,6-dimethyl-3,4,5-tris(phenylmethoxy)oxane
• SMILES: CC1O[C@@H](OC2[C@H](O[C@@H]3C(NC(=O)OCC(Cl)(Cl)Cl)[C@H](O[C@@H]4C(OCc5ccccc5)[C@@H](O[C@H]5C(COCc6ccccc6)O[C@@H](O[C@@H]6C(COCc7ccccc7)O[C@@H](OCCCCCNC(=O)OCc7ccccc7)C(OCc7ccccc7)[C@@H]6OCc6ccccc6)C(OCc6ccccc6)C5OCc5ccccc5)OC5COC(c6ccccc6)O[C@@H]54)OC(COC(=O)c4ccccc4)[C@@H]3OC(=O)c3ccccc3)OC(COCc3ccccc3)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)C(OCc2ccccc2)[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1.CC1O[C@H](C)C(OCc2ccccc2)C(OCc2ccccc2)[C@@H]1OCc1ccccc1.C[C@@H]1OC(COC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H](O[C@@H]2OC(COCc3ccccc3)[C@H](OCc3ccccc3)[C@@H](OCc3ccccc3)C2O)C1NC(=O)OCC(Cl)(Cl)Cl.O=C(NCCCCCO[C@@H]1OC(COCc2ccccc2)[C@@H](O[C@@H]2OC(COCc3ccccc3)[C@H](O[C@H]3OC4COC(c5ccccc5)O[C@@H]4[C@H](O)C3OCc3ccccc3)[C@@H](OCc3ccccc3)C2OCc2ccccc2)[C@@H](OCc2ccccc2)C1OCc1ccccc1)OCc1ccccc1
• InChI: InChI=1S/C164H171Cl3N2O35.C87H95NO18.C51H52Cl3NO13.C28H32O4/c1-112-136(178-95-116-62-26-5-27-63-116)143(180-97-118-66-30-7-31-67-118)149(185-102-123-76-40-12-41-77-123)158(192-112)204-152-144(181-98-119-68-32-8-33-69-119)137(179-96-117-64-28-6-29-65-117)130(106-174-92-113-56-20-2-21-57-113)195-161(152)202-142-135(169-163(173)191-111-164(165,166)167)156(193-133(109-188-153(170)127-84-48-16-49-85-127)138(142)198-154(171)128-86-50-17-51-87-128)203-147-141-134(110-189-155(199-141)129-88-52-18-53-89-129)197-160(151(147)187-104-125-80-44-14-45-81-125)201-140-132(108-176-94-115-60-24-4-25-61-115)196-159(150(186-103-124-78-42-13-43-79-124)146(140)183-100-121-72-36-10-37-73-121)200-139-131(107-175-93-114-58-22-3-23-59-114)194-157(177-91-55-19-54-90-168-162(172)190-105-126-82-46-15-47-83-126)148(184-101-122-74-38-11-39-75-122)145(139)182-99-120-70-34-9-35-71-120;89-74-75-73(61-99-83(104-75)70-47-27-9-28-48-70)103-85(78(74)94-53-64-35-15-3-16-36-64)105-77-72(60-92-52-63-33-13-2-14-34-63)102-86(82(98-57-68-43-23-7-24-44-68)80(77)96-55-66-39-19-5-20-40-66)106-76-71(59-91-51-62-31-11-1-12-32-62)101-84(93-50-30-10-29-49-88-87(90)100-58-69-45-25-8-26-46-69)81(97-56-67-41-21-6-22-42-67)79(76)95-54-65-37-17-4-18-38-65;1-33-41(55-50(59)64-32-51(52,53)54)45(44(67-48(58)38-25-15-6-16-26-38)40(65-33)31-63-47(57)37-23-13-5-14-24-37)68-49-42(56)46(62-29-36-21-11-4-12-22-36)43(61-28-35-19-9-3-10-20-35)39(66-49)30-60-27-34-17-7-2-8-18-34;1-21-26(29-18-23-12-6-3-7-13-23)28(31-20-25-16-10-5-11-17-25)27(22(2)32-21)30-19-24-14-8-4-9-15-24/h2-18,20-53,56-89,112,130-152,155-161H,19,54-55,90-111H2,1H3,(H,168,172)(H,169,173);1-9,11-28,31-48,71-86,89H,10,29-30,49-61H2,(H,88,90);2-26,33,39-46,49,56H,27-32H2,1H3,(H,55,59);3-17,21-22,26-28H,18-20H2,1-2H3/t112?,130?,131?,132?,133?,134?,135?,136-,137+,138+,139-,140+,141+,142-,143+,144-,145-,146?,147+,148?,149?,150?,151?,152?,155?,156+,157-,158+,159+,160-,161+;71?,72?,73?,74-,75-,76+,77-,78?,79+,80+,81?,82?,83?,84+,85+,86-;33-,39?,40?,41?,42?,43-,44-,45+,46-,49-;21-,22?,26?,27-,28?/m1001/s1
• InChIKey: KMOVZKZZHJCFKT-COGKNVTNSA-N
• XLogP: 55.17
• TPSA: 778.94 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 70
• Rotatable Bonds: 134
• Heavy Atoms: 410
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	5705.11
LogP ≤ 5	55.17
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	70

Frequently Asked Questions

What is the IUPAC name of [(3R,4R,6S)-6-[[(6R,8S,8aS)-6-[(3S,4R,6S)-6-[(3R,4R,6R)-4,5-bis(phenylmethoxy)-6-[5-(phenylmethoxycarbonylamino)pentoxy]-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl]oxy]-3-benzoyloxy-4-[(2R,4R,5S)-3-[(2S,4S,5R)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;[(3R,4R,6S)-3-benzoyloxy-4-[(2R,4S,5S)-3-hydroxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-6-methyl-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;benzyl N-[5-[(2R,4R,5R)-5-[(2S,4R,5S)-5-[[(6R,8S,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]carbamate;(3R,6R)-2,6-dimethyl-3,4,5-tris(phenylmethoxy)oxane?

The IUPAC name of [(3R,4R,6S)-6-[[(6R,8S,8aS)-6-[(3S,4R,6S)-6-[(3R,4R,6R)-4,5-bis(phenylmethoxy)-6-[5-(phenylmethoxycarbonylamino)pentoxy]-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl]oxy]-3-benzoyloxy-4-[(2R,4R,5S)-3-[(2S,4S,5R)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;[(3R,4R,6S)-3-benzoyloxy-4-[(2R,4S,5S)-3-hydroxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-6-methyl-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;benzyl N-[5-[(2R,4R,5R)-5-[(2S,4R,5S)-5-[[(6R,8S,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]carbamate;(3R,6R)-2,6-dimethyl-3,4,5-tris(phenylmethoxy)oxane (CID 159178513) is [(3R,4R,6S)-6-[[(6R,8S,8aS)-6-[(3S,4R,6S)-6-[(3R,4R,6R)-4,5-bis(phenylmethoxy)-6-[5-(phenylmethoxycarbonylamino)pentoxy]-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl]oxy]-3-benzoyloxy-4-[(2R,4R,5S)-3-[(2S,4S,5R)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;[(3R,4R,6S)-3-benzoyloxy-4-[(2R,4S,5S)-3-hydroxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-6-methyl-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;benzyl N-[5-[(2R,4R,5R)-5-[(2S,4R,5S)-5-[[(6R,8S,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]carbamate;(3R,6R)-2,6-dimethyl-3,4,5-tris(phenylmethoxy)oxane.

What is the SMILES notation for [(3R,4R,6S)-6-[[(6R,8S,8aS)-6-[(3S,4R,6S)-6-[(3R,4R,6R)-4,5-bis(phenylmethoxy)-6-[5-(phenylmethoxycarbonylamino)pentoxy]-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl]oxy]-3-benzoyloxy-4-[(2R,4R,5S)-3-[(2S,4S,5R)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;[(3R,4R,6S)-3-benzoyloxy-4-[(2R,4S,5S)-3-hydroxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-6-methyl-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;benzyl N-[5-[(2R,4R,5R)-5-[(2S,4R,5S)-5-[[(6R,8S,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]carbamate;(3R,6R)-2,6-dimethyl-3,4,5-tris(phenylmethoxy)oxane?

The canonical SMILES for [(3R,4R,6S)-6-[[(6R,8S,8aS)-6-[(3S,4R,6S)-6-[(3R,4R,6R)-4,5-bis(phenylmethoxy)-6-[5-(phenylmethoxycarbonylamino)pentoxy]-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl]oxy]-3-benzoyloxy-4-[(2R,4R,5S)-3-[(2S,4S,5R)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;[(3R,4R,6S)-3-benzoyloxy-4-[(2R,4S,5S)-3-hydroxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-6-methyl-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;benzyl N-[5-[(2R,4R,5R)-5-[(2S,4R,5S)-5-[[(6R,8S,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]carbamate;(3R,6R)-2,6-dimethyl-3,4,5-tris(phenylmethoxy)oxane is CC1O[C@@H](OC2[C@H](O[C@@H]3C(NC(=O)OCC(Cl)(Cl)Cl)[C@H](O[C@@H]4C(OCc5ccccc5)[C@@H](O[C@H]5C(COCc6ccccc6)O[C@@H](O[C@@H]6C(COCc7ccccc7)O[C@@H](OCCCCCNC(=O)OCc7ccccc7)C(OCc7ccccc7)[C@@H]6OCc6ccccc6)C(OCc6ccccc6)C5OCc5ccccc5)OC5COC(c6ccccc6)O[C@@H]54)OC(COC(=O)c4ccccc4)[C@@H]3OC(=O)c3ccccc3)OC(COCc3ccccc3)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)C(OCc2ccccc2)[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1.CC1O[C@H](C)C(OCc2ccccc2)C(OCc2ccccc2)[C@@H]1OCc1ccccc1.C[C@@H]1OC(COC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H](O[C@@H]2OC(COCc3ccccc3)[C@H](OCc3ccccc3)[C@@H](OCc3ccccc3)C2O)C1NC(=O)OCC(Cl)(Cl)Cl.O=C(NCCCCCO[C@@H]1OC(COCc2ccccc2)[C@@H](O[C@@H]2OC(COCc3ccccc3)[C@H](O[C@H]3OC4COC(c5ccccc5)O[C@@H]4[C@H](O)C3OCc3ccccc3)[C@@H](OCc3ccccc3)C2OCc2ccccc2)[C@@H](OCc2ccccc2)C1OCc1ccccc1)OCc1ccccc1.

What is the InChIKey of [(3R,4R,6S)-6-[[(6R,8S,8aS)-6-[(3S,4R,6S)-6-[(3R,4R,6R)-4,5-bis(phenylmethoxy)-6-[5-(phenylmethoxycarbonylamino)pentoxy]-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl]oxy]-3-benzoyloxy-4-[(2R,4R,5S)-3-[(2S,4S,5R)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;[(3R,4R,6S)-3-benzoyloxy-4-[(2R,4S,5S)-3-hydroxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-6-methyl-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;benzyl N-[5-[(2R,4R,5R)-5-[(2S,4R,5S)-5-[[(6R,8S,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]carbamate;(3R,6R)-2,6-dimethyl-3,4,5-tris(phenylmethoxy)oxane?

The InChIKey is KMOVZKZZHJCFKT-COGKNVTNSA-N. The full InChI is InChI=1S/C164H171Cl3N2O35.C87H95NO18.C51H52Cl3NO13.C28H32O4/c1-112-136(178-95-116-62-26-5-27-63-116)143(180-97-118-66-30-7-31-67-118)149(185-102-123-76-40-12-41-77-123)158(192-112)204-152-144(181-98-119-68-32-8-33-69-119)137(179-96-117-64-28-6-29-65-117)130(106-174-92-113-56-20-2-21-57-113)195-161(152)202-142-135(169-163(173)191-111-164(165,166)167)156(193-133(109-188-153(170)127-84-48-16-49-85-127)138(142)198-154(171)128-86-50-17-51-87-128)203-147-141-134(110-189-155(199-141)129-88-52-18-53-89-129)197-160(151(147)187-104-125-80-44-14-45-81-125)201-140-132(108-176-94-115-60-24-4-25-61-115)196-159(150(186-103-124-78-42-13-43-79-124)146(140)183-100-121-72-36-10-37-73-121)200-139-131(107-175-93-114-58-22-3-23-59-114)194-157(177-91-55-19-54-90-168-162(172)190-105-126-82-46-15-47-83-126)148(184-101-122-74-38-11-39-75-122)145(139)182-99-120-70-34-9-35-71-120;89-74-75-73(61-99-83(104-75)70-47-27-9-28-48-70)103-85(78(74)94-53-64-35-15-3-16-36-64)105-77-72(60-92-52-63-33-13-2-14-34-63)102-86(82(98-57-68-43-23-7-24-44-68)80(77)96-55-66-39-19-5-20-40-66)106-76-71(59-91-51-62-31-11-1-12-32-62)101-84(93-50-30-10-29-49-88-87(90)100-58-69-45-25-8-26-46-69)81(97-56-67-41-21-6-22-42-67)79(76)95-54-65-37-17-4-18-38-65;1-33-41(55-50(59)64-32-51(52,53)54)45(44(67-48(58)38-25-15-6-16-26-38)40(65-33)31-63-47(57)37-23-13-5-14-24-37)68-49-42(56)46(62-29-36-21-11-4-12-22-36)43(61-28-35-19-9-3-10-20-35)39(66-49)30-60-27-34-17-7-2-8-18-34;1-21-26(29-18-23-12-6-3-7-13-23)28(31-20-25-16-10-5-11-17-25)27(22(2)32-21)30-19-24-14-8-4-9-15-24/h2-18,20-53,56-89,112,130-152,155-161H,19,54-55,90-111H2,1H3,(H,168,172)(H,169,173);1-9,11-28,31-48,71-86,89H,10,29-30,49-61H2,(H,88,90);2-26,33,39-46,49,56H,27-32H2,1H3,(H,55,59);3-17,21-22,26-28H,18-20H2,1-2H3/t112?,130?,131?,132?,133?,134?,135?,136-,137+,138+,139-,140+,141+,142-,143+,144-,145-,146?,147+,148?,149?,150?,151?,152?,155?,156+,157-,158+,159+,160-,161+;71?,72?,73?,74-,75-,76+,77-,78?,79+,80+,81?,82?,83?,84+,85+,86-;33-,39?,40?,41?,42?,43-,44-,45+,46-,49-;21-,22?,26?,27-,28?/m1001/s1.

What are the key properties of [(3R,4R,6S)-6-[[(6R,8S,8aS)-6-[(3S,4R,6S)-6-[(3R,4R,6R)-4,5-bis(phenylmethoxy)-6-[5-(phenylmethoxycarbonylamino)pentoxy]-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl]oxy]-3-benzoyloxy-4-[(2R,4R,5S)-3-[(2S,4S,5R)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;[(3R,4R,6S)-3-benzoyloxy-4-[(2R,4S,5S)-3-hydroxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-6-methyl-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;benzyl N-[5-[(2R,4R,5R)-5-[(2S,4R,5S)-5-[[(6R,8S,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]carbamate;(3R,6R)-2,6-dimethyl-3,4,5-tris(phenylmethoxy)oxane?

[(3R,4R,6S)-6-[[(6R,8S,8aS)-6-[(3S,4R,6S)-6-[(3R,4R,6R)-4,5-bis(phenylmethoxy)-6-[5-(phenylmethoxycarbonylamino)pentoxy]-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl]oxy]-3-benzoyloxy-4-[(2R,4R,5S)-3-[(2S,4S,5R)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;[(3R,4R,6S)-3-benzoyloxy-4-[(2R,4S,5S)-3-hydroxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-6-methyl-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;benzyl N-[5-[(2R,4R,5R)-5-[(2S,4R,5S)-5-[[(6R,8S,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]carbamate;(3R,6R)-2,6-dimethyl-3,4,5-tris(phenylmethoxy)oxane has a molecular weight of 5705.11 g/mol, XLogP of 55.17, 134 rotatable bonds, 6 hydrogen bond donors, and 70 hydrogen bond acceptors.

Where does this data come from?

All data for [(3R,4R,6S)-6-[[(6R,8S,8aS)-6-[(3S,4R,6S)-6-[(3R,4R,6R)-4,5-bis(phenylmethoxy)-6-[5-(phenylmethoxycarbonylamino)pentoxy]-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl]oxy]-3-benzoyloxy-4-[(2R,4R,5S)-3-[(2S,4S,5R)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;[(3R,4R,6S)-3-benzoyloxy-4-[(2R,4S,5S)-3-hydroxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-6-methyl-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl benzoate;benzyl N-[5-[(2R,4R,5R)-5-[(2S,4R,5S)-5-[[(6R,8S,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]carbamate;(3R,6R)-2,6-dimethyl-3,4,5-tris(phenylmethoxy)oxane is sourced from PubChem (CID 159178513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).