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[(2R,3R,4R,6S)-6-[(2R,2'R,3'S,3aR,4R,4'R,6S,7S,7aR)-6-[(2S,3R,4S,5S,6R)-2-[(2R,3S,4S,5S,6S)-6-[(3'aS,6'S,7R,7'R,7aS,7'aS)-7-[2-methyl-4,6-bis(oxidanyl)phenyl]carbonyloxy-7'-oxidanyl-spiro[3a,6,7,7a-tetrahydro-[1,3]dioxolo[4,5-c]pyran-4,2'-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran]-6'-yl]oxy-5-methoxy-2-(methoxymethyl)-4-oxidanyl-oxan-3-yl]oxy-5,6-dimethyl-3-oxidanyl-oxan-4-yl]oxy-2',4,7a-trimethyl-4',7-bis(oxidanyl)spiro[3a,4,6,7-tetrahydro-[1,3]dioxolo[4,5-c]pyran-2,6'-oxane]-3'-yl]oxy-4-[(2S,4S,5R,

Systemtic Name:	[(2R,3R,4R,6S)-6-[(2R,2'R,3'S,3aR,4R,4'R,6S,7S,7aR)-6-[(2S,3R,4S,5S,6R)-2-[(2R,3S,4S,5S,6S)-6-[(3'aS,6'S,7R,7'R,7aS,7'aS)-7-[2-methyl-4,6-bis(oxidanyl)phenyl]carbonyloxy-7'-oxidanyl-spiro[3a,6,7,7a-tetrahydro-[1,3]dioxolo[4,5-c]pyran-4,2'-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran]-6'-yl]oxy-5-methoxy-2-(methoxymethyl)-4-oxidanyl-oxan-3-yl]oxy-5,6-dimethyl-3-oxidanyl-oxan-4-yl]oxy-2',4,7a-trimethyl-4',7-bis(oxidanyl)spiro[3a,4,6,7-tetrahydro-[1,3]dioxolo[4,5-c]pyran-2,6'-oxane]-3'-yl]oxy-4-[(2S,4S,5R,
Openeye Name:	[(2R,3R,4R,6S)-6-[(2R,2'R,3'S,3aR,4R,4'R,6S,7S,7aR)-6-[(2S,3R,4S,5S,6R)-2-[(2R,3S,4S,5S,6S)-6-[(3'aS,6'S,7R,7'R,7aS,7'aS)-7-(2,4-dihydroxy-6-methyl-benzoyl)oxy-7'-hydroxy-spiro[3a,6,7,7a-tetrahydro-[1,3]dioxolo[4,5-c]pyran-4,2'-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran]-6'-yl]oxy-4-hydroxy-5-methoxy-2-(methoxymethyl)tetrahydropyran-3-yl]oxy-3-hydroxy-5,6-dimethyl-tetrahydropyran-4-yl]oxy-4',7-dihydroxy-2',4,7a-trimethyl-spiro[3a,4,6,7-tetrahydro-[1,3]dioxolo[4,5-c]pyran-2,6'-tetrahydropyran]-3'-yl]ox
CAS Name:	3-chloro-4-hydroxy-2-methoxy-6-methylbenzoic acid [(2R,3R,4R,6S)-6-[[(2R,2'R,3'S,3aR,4R,4'R,6S,7S,7aR)-6-[[(2S,3R,4S,5S,6R)-2-[[(2R,3S,4S,5S,6S)-6-[[(3'aS,6'S,7R,7'R,7aS,7'aS)-7-[(2,4-dihydroxy-6-methylphenyl)-oxomethoxy]-7'-hydroxy-6'-spiro[3a,6,7,7a-tetrahydro-[1,3]dioxolo[4,5-c]pyran-4,2'-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran]yl]oxy]-4-hydroxy-5-methoxy-2-(methoxymethyl)-3-oxanyl]oxy]-3-hydroxy-5,6-dimethyl-4-oxanyl]oxy]-4',7-dihydroxy-2',4,7a-trimethyl-3'-spiro[3a,4,6,7-tetrahydro-[1,3]dioxol
IUPAC Name:	[(2R,3R,4R,6S)-6-[(2R,2'R,3'S,3aR,4R,4'R,6S,7S,7aR)-6-[(2S,3R,4S,5S,6R)-2-[(2R,3S,4S,5S,6S)-6-[(3'aS,6'S,7R,7'R,7aS,7'aS)-7-(2,4-dihydroxy-6-methylbenzoyl)oxy-7'-hydroxyspiro[3a,6,7,7a-tetrahydro-[1,3]dioxolo[4,5-c]pyran-4,2'-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran]-6'-yl]oxy-4-hydroxy-5-methoxy-2-(methoxymethyl)oxan-3-yl]oxy-3-hydroxy-5,6-dimethyloxan-4-yl]oxy-4',7-dihydroxy-2',4,7a-trimethylspiro[3a,4,6,7-tetrahydro-[1,3]dioxolo[4,5-c]pyran-2,6'-oxane]-3'-yl]oxy-4-[(2S,4S,5R,6S)-5-methoxy-4,6-dim
Traditional Name:	3-chloro-4-hydroxy-2-methoxy-6-methyl-benzoic acid [(2R,3R,4R,6S)-6-[(2R,2'R,3'S,3aR,4R,4'R,6S,7S,7aR)-6-[(2S,3R,4S,5S,6R)-2-[(2R,3S,4S,5S,6S)-6-[(3'aS,6'S,7R,7'R,7aS,7'aS)-7-(2,4-dihydroxy-6-methyl-benzoyl)oxy-7'-hydroxy-spiro[3a,6,7,7a-tetrahydro-[1,3]dioxolo[4,5-c]pyran-4,2'-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran]-6'-yl]oxy-4-hydroxy-5-methoxy-2-(methoxymethyl)tetrahydropyran-3-yl]oxy-3-hydroxy-5,6-dimethyl-tetrahydropyran-4-yl]oxy-4',7-dihydroxy-2',4,7a-trimethyl-spiro[3a,4,6,7-tetrahydro-[1,3
Formula:	C₇₀H₉₈ClNO₃₇
MolecularWeight:	1580.96462

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC(C(C1OC2C(C3(C(C(O2)C)OC4(O3)CC(C(C(O4)C)OC5CC(C(C(O5)C)OC(=O)C6=C(C(=C(C=C6C)O)Cl)OC)OC7CC(C(C(O7)C)OC)(C)[N+](=O)[O-])O)C)O)O)OC8C(OC(C(C8O)OC)OC9C(C1C(CO9)OC2(O1)C1C(C(CO2)OC(=O)C2=C(C=C(C=C2C)O)O)OCO1)O)COC)C

Isomeric SMILES

C[C@H]1[C@H](O[C@H]([C@@H]([C@H]1O[C@H]2[C@H]([C@@]3([C@@H]([C@H](O2)C)O[C@@]4(O3)C[C@H]([C@@H]([C@H](O4)C)O[C@H]5C[C@H]([C@@H]([C@H](O5)C)OC(=O)C6=C(C(=C(C=C6C)O)Cl)OC)O[C@H]7C[C@]([C@H]([C@@H](O7)C)OC)(C)[N+](=O)[O-])O)C)O)O)O[C@@H]8[C@H](O[C@H]([C@H]([C@H]8O)OC)O[C@H]9[C@@H]([C@H]1[C@H](CO9)OC2(O1)C1[C@H]([C@@H](CO2)OC(=O)C2=C(C=C(C=C2C)O)O)OCO1)O)COC)C

InChI

InChI=1S/C70H98ClNO37/c1-25-15-33(73)17-34(74)43(25)61(81)98-39-23-92-70(60-54(39)90-24-91-60)106-40-22-89-63(48(79)53(40)107-70)104-65-56(87-13)46(77)52(38(99-65)21-85-11)103-64-47(78)49(27(3)28(4)95-64)102-66-57(80)68(10)59(32(8)96-66)108-69(109-68)19-36(76)50(30(6)105-69)100-41-18-37(97-42-20-67(9,72(83)84)58(88-14)31(7)94-42)51(29(5)93-41)101-62(82)44-26(2)16-35(75)45(71)55(44)86-12/h15-17,27-32,36-42,46-54,56-60,63-66,73-80H,18-24H2,1-14H3/t27-,28+,29+,30+,31-,32+,36+,37+,38+,39+,40-,41-,42-,46-,47+,48+,49-,50+,51+,52+,53+,54-,56-,57+,58-,59+,60?,63-,64-,65-,66-,67-,68+,69+,70?/m0/s1

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