[(2R,3S,4S,5R,6S)-5-[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-6-[[(2S,3S,4S,5R,6R)-4-[(2E)-2-[(5S)-5-ethenyl-5-methyloxolan-2-ylidene]-3-hydroxypropanoyl]oxy-5-hydroxy-3-[(2Z,6R)-6-hydroxy-2,6-dimethylocta-2,7-dienoyl]oxy-6-methyloxan-2-yl]oxymethyl]-3,4-dihydroxyoxan-2-yl] (4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2R,3R,4S,5S,6R)-6-[[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate

C94H146O43 — CID 76900289

About [(2R,3S,4S,5R,6S)-5-[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-6-[[(2S,3S,4S,5R,6R)-4-[(2E)-2-[(5S)-5-ethenyl-5-methyloxolan-2-ylidene]-3-hydroxypropanoyl]oxy-5-hydroxy-3-[(2Z,6R)-6-hydroxy-2,6-dimethylocta-2,7-dienoyl]oxy-6-methyloxan-2-yl]oxymethyl]-3,4-dihydroxyoxan-2-yl] (4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2R,3R,4S,5S,6R)-6-[[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate

[(2R,3S,4S,5R,6S)-5-[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-6-[[(2S,3S,4S,5R,6R)-4-[(2E)-2-[(5S)-5-ethenyl-5-methyloxolan-2-ylidene]-3-hydroxypropanoyl]oxy-5-hydroxy-3-[(2Z,6R)-6-hydroxy-2,6-dimethylocta-2,7-dienoyl]oxy-6-methyloxan-2-yl]oxymethyl]-3,4-dihydroxyoxan-2-yl] (4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2R,3R,4S,5S,6R)-6-[[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate (PubChem CID 76900289) has the molecular formula C94H146O43 and a molecular weight of 1964.16 g/mol. Its IUPAC name is [(2R,3S,4S,5R,6S)-5-[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-6-[[(2S,3S,4S,5R,6R)-4-[(2E)-2-[(5S)-5-ethenyl-5-methyloxolan-2-ylidene]-3-hydroxypropanoyl]oxy-5-hydroxy-3-[(2Z,6R)-6-hydroxy-2,6-dimethylocta-2,7-dienoyl]oxy-6-methyloxan-2-yl]oxymethyl]-3,4-dihydroxyoxan-2-yl] (4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2R,3R,4S,5S,6R)-6-[[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate.

Molecular Properties

• Compound Name: [(2R,3S,4S,5R,6S)-5-[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-6-[[(2S,3S,4S,5R,6R)-4-[(2E)-2-[(5S)-5-ethenyl-5-methyloxolan-2-ylidene]-3-hydroxypropanoyl]oxy-5-hydroxy-3-[(2Z,6R)-6-hydroxy-2,6-dimethylocta-2,7-dienoyl]oxy-6-methyloxan-2-yl]oxymethyl]-3,4-dihydroxyoxan-2-yl] (4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2R,3R,4S,5S,6R)-6-[[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
• PubChem CID: 76900289
• Molecular Formula: C94H146O43
• Molecular Weight: 1964.16 g/mol
• Exact Mass: 1962.92
• IUPAC Name: [(2R,3S,4S,5R,6S)-5-[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-6-[[(2S,3S,4S,5R,6R)-4-[(2E)-2-[(5S)-5-ethenyl-5-methyloxolan-2-ylidene]-3-hydroxypropanoyl]oxy-5-hydroxy-3-[(2Z,6R)-6-hydroxy-2,6-dimethylocta-2,7-dienoyl]oxy-6-methyloxan-2-yl]oxymethyl]-3,4-dihydroxyoxan-2-yl] (4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2R,3R,4S,5S,6R)-6-[[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
• SMILES: C=C[C@](C)(O)CC/C=C(/C)C(=O)O[C@@H]1[C@@H](OC[C@@H]2O[C@H](OC(=O)[C@]34CCC(C)(C)C[C@H]3C3=CC[C@@H]5[C@@]6(C)CC[C@H](O[C@@H]7O[C@H](CO[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O[C@@H]8OC[C@@H](O)[C@H](O)[C@H]8O)[C@@H](O)[C@H](O)[C@H]7O)C(C)(C)[C@@H]6CC[C@@]5(C)[C@]3(C)C[C@H]4O)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](C)[C@@H](O[C@@H]3OC[C@@H](O)[C@H](O[C@@H]4OC[C@@H](O)[C@H](O)[C@H]4O)[C@H]3O)[C@H](O)[C@@H]2O)O[C@H](C)[C@@H](O)[C@@H]1OC(=O)/C(CO)=C1\CC[C@@](C)(C=C)O1
• InChI: InChI=1S/C94H146O43/c1-15-89(10,118)24-17-18-39(3)76(115)131-75-73(130-77(116)42(32-95)49-21-25-90(11,16-2)137-49)56(101)40(4)125-85(75)124-38-51-72(134-81-67(112)62(107)70(41(5)126-81)132-80-69(114)71(48(99)36-121-80)133-78-64(109)57(102)45(96)33-119-78)63(108)68(113)83(128-51)136-86(117)94-29-28-87(6,7)30-44(94)43-19-20-53-91(12)26-23-55(88(8,9)52(91)22-27-92(53,13)93(43,14)31-54(94)100)129-82-66(111)61(106)60(105)50(127-82)37-123-84-74(59(104)47(98)35-122-84)135-79-65(110)58(103)46(97)34-120-79/h15-16,18-19,40-41,44-48,50-75,78-85,95-114,118H,1-2,17,20-38H2,3-14H3/b39-18-,49-42+/t40-,41-,44+,45-,46-,47+,48-,50-,51+,52+,53-,54-,55+,56-,57+,58+,59+,60-,61+,62-,63+,64-,65-,66-,67+,68+,69-,70-,71+,72+,73+,74-,75+,78+,79+,80+,81+,82+,83-,84+,85+,89+,90-,91+,92-,93-,94-/m1/s1
• InChIKey: YLJAIRPZWCYGCM-UJWLGOGZSA-N
• XLogP: -3.39
• TPSA: 651.41 Ų
• H-Bond Donors: 21
• H-Bond Acceptors: 43
• Rotatable Bonds: 28
• Heavy Atoms: 137
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1964.16
LogP ≤ 5	-3.39
H-Bond Donors ≤ 5	21
H-Bond Acceptors ≤ 10	43

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'saponine_derivative', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [(2R,3S,4S,5R,6S)-5-[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-6-[[(2S,3S,4S,5R,6R)-4-[(2E)-2-[(5S)-5-ethenyl-5-methyloxolan-2-ylidene]-3-hydroxypropanoyl]oxy-5-hydroxy-3-[(2Z,6R)-6-hydroxy-2,6-dimethylocta-2,7-dienoyl]oxy-6-methyloxan-2-yl]oxymethyl]-3,4-dihydroxyoxan-2-yl] (4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2R,3R,4S,5S,6R)-6-[[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate?

The IUPAC name of [(2R,3S,4S,5R,6S)-5-[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-6-[[(2S,3S,4S,5R,6R)-4-[(2E)-2-[(5S)-5-ethenyl-5-methyloxolan-2-ylidene]-3-hydroxypropanoyl]oxy-5-hydroxy-3-[(2Z,6R)-6-hydroxy-2,6-dimethylocta-2,7-dienoyl]oxy-6-methyloxan-2-yl]oxymethyl]-3,4-dihydroxyoxan-2-yl] (4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2R,3R,4S,5S,6R)-6-[[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate (CID 76900289) is [(2R,3S,4S,5R,6S)-5-[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-6-[[(2S,3S,4S,5R,6R)-4-[(2E)-2-[(5S)-5-ethenyl-5-methyloxolan-2-ylidene]-3-hydroxypropanoyl]oxy-5-hydroxy-3-[(2Z,6R)-6-hydroxy-2,6-dimethylocta-2,7-dienoyl]oxy-6-methyloxan-2-yl]oxymethyl]-3,4-dihydroxyoxan-2-yl] (4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2R,3R,4S,5S,6R)-6-[[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate.

What is the SMILES notation for [(2R,3S,4S,5R,6S)-5-[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-6-[[(2S,3S,4S,5R,6R)-4-[(2E)-2-[(5S)-5-ethenyl-5-methyloxolan-2-ylidene]-3-hydroxypropanoyl]oxy-5-hydroxy-3-[(2Z,6R)-6-hydroxy-2,6-dimethylocta-2,7-dienoyl]oxy-6-methyloxan-2-yl]oxymethyl]-3,4-dihydroxyoxan-2-yl] (4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2R,3R,4S,5S,6R)-6-[[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate?

The canonical SMILES for [(2R,3S,4S,5R,6S)-5-[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-6-[[(2S,3S,4S,5R,6R)-4-[(2E)-2-[(5S)-5-ethenyl-5-methyloxolan-2-ylidene]-3-hydroxypropanoyl]oxy-5-hydroxy-3-[(2Z,6R)-6-hydroxy-2,6-dimethylocta-2,7-dienoyl]oxy-6-methyloxan-2-yl]oxymethyl]-3,4-dihydroxyoxan-2-yl] (4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2R,3R,4S,5S,6R)-6-[[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate is C=C[C@](C)(O)CC/C=C(/C)C(=O)O[C@@H]1[C@@H](OC[C@@H]2O[C@H](OC(=O)[C@]34CCC(C)(C)C[C@H]3C3=CC[C@@H]5[C@@]6(C)CC[C@H](O[C@@H]7O[C@H](CO[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O[C@@H]8OC[C@@H](O)[C@H](O)[C@H]8O)[C@@H](O)[C@H](O)[C@H]7O)C(C)(C)[C@@H]6CC[C@@]5(C)[C@]3(C)C[C@H]4O)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](C)[C@@H](O[C@@H]3OC[C@@H](O)[C@H](O[C@@H]4OC[C@@H](O)[C@H](O)[C@H]4O)[C@H]3O)[C@H](O)[C@@H]2O)O[C@H](C)[C@@H](O)[C@@H]1OC(=O)/C(CO)=C1\CC[C@@](C)(C=C)O1.

What is the InChIKey of [(2R,3S,4S,5R,6S)-5-[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-6-[[(2S,3S,4S,5R,6R)-4-[(2E)-2-[(5S)-5-ethenyl-5-methyloxolan-2-ylidene]-3-hydroxypropanoyl]oxy-5-hydroxy-3-[(2Z,6R)-6-hydroxy-2,6-dimethylocta-2,7-dienoyl]oxy-6-methyloxan-2-yl]oxymethyl]-3,4-dihydroxyoxan-2-yl] (4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2R,3R,4S,5S,6R)-6-[[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate?

The InChIKey is YLJAIRPZWCYGCM-UJWLGOGZSA-N. The full InChI is InChI=1S/C94H146O43/c1-15-89(10,118)24-17-18-39(3)76(115)131-75-73(130-77(116)42(32-95)49-21-25-90(11,16-2)137-49)56(101)40(4)125-85(75)124-38-51-72(134-81-67(112)62(107)70(41(5)126-81)132-80-69(114)71(48(99)36-121-80)133-78-64(109)57(102)45(96)33-119-78)63(108)68(113)83(128-51)136-86(117)94-29-28-87(6,7)30-44(94)43-19-20-53-91(12)26-23-55(88(8,9)52(91)22-27-92(53,13)93(43,14)31-54(94)100)129-82-66(111)61(106)60(105)50(127-82)37-123-84-74(59(104)47(98)35-122-84)135-79-65(110)58(103)46(97)34-120-79/h15-16,18-19,40-41,44-48,50-75,78-85,95-114,118H,1-2,17,20-38H2,3-14H3/b39-18-,49-42+/t40-,41-,44+,45-,46-,47+,48-,50-,51+,52+,53-,54-,55+,56-,57+,58+,59+,60-,61+,62-,63+,64-,65-,66-,67+,68+,69-,70-,71+,72+,73+,74-,75+,78+,79+,80+,81+,82+,83-,84+,85+,89+,90-,91+,92-,93-,94-/m1/s1.

What are the key properties of [(2R,3S,4S,5R,6S)-5-[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-6-[[(2S,3S,4S,5R,6R)-4-[(2E)-2-[(5S)-5-ethenyl-5-methyloxolan-2-ylidene]-3-hydroxypropanoyl]oxy-5-hydroxy-3-[(2Z,6R)-6-hydroxy-2,6-dimethylocta-2,7-dienoyl]oxy-6-methyloxan-2-yl]oxymethyl]-3,4-dihydroxyoxan-2-yl] (4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2R,3R,4S,5S,6R)-6-[[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate?

[(2R,3S,4S,5R,6S)-5-[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-6-[[(2S,3S,4S,5R,6R)-4-[(2E)-2-[(5S)-5-ethenyl-5-methyloxolan-2-ylidene]-3-hydroxypropanoyl]oxy-5-hydroxy-3-[(2Z,6R)-6-hydroxy-2,6-dimethylocta-2,7-dienoyl]oxy-6-methyloxan-2-yl]oxymethyl]-3,4-dihydroxyoxan-2-yl] (4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2R,3R,4S,5S,6R)-6-[[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate has a molecular weight of 1964.16 g/mol, XLogP of -3.39, 28 rotatable bonds, 21 hydrogen bond donors, and 43 hydrogen bond acceptors.

Where does this data come from?

All data for [(2R,3S,4S,5R,6S)-5-[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-6-[[(2S,3S,4S,5R,6R)-4-[(2E)-2-[(5S)-5-ethenyl-5-methyloxolan-2-ylidene]-3-hydroxypropanoyl]oxy-5-hydroxy-3-[(2Z,6R)-6-hydroxy-2,6-dimethylocta-2,7-dienoyl]oxy-6-methyloxan-2-yl]oxymethyl]-3,4-dihydroxyoxan-2-yl] (4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2R,3R,4S,5S,6R)-6-[[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate is sourced from PubChem (CID 76900289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).