Chem
J-GLOBAL ID:200907028895686753
Nikkaji number:J2.261.801F
2-[2-Hydroxy-4-[3,5-bis[3,5-bis[3,5-bis(methoxycarbonyl)benzyloxy]benzyloxy]benzyloxy]phenyl]-5-[3,5-bis[3,5-bis[3,5-bis(methoxycarbonyl)benzyloxy]benzyloxy]benzyloxy]benzoxazole
2-[2-ヒドロキシ-4-[3,5-ビス[3,5-ビス[3,5-ビス(メトキシカルボニル)ベンジルオキシ]ベンジルオキシ]ベンジルオキシ]フェニル]-5-[3,5-ビス[3,5-ビス[3,5-ビス(メトキシカルボニル)ベンジルオキシ]ベンジルオキシ]ベンジルオキシ]ベンゾオキサゾール
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C143 H125 NO48
Molecular formula furigana:
C143-H125-N-O48
Molecular weight:
2625.532
InChI:
InChI=1S/C143H125NO48/c1-162-128(146)93-21-79(22-94(49-93)129(147)163-2)65-180-111-41-89(42-112(57-111)181-66-80-23-95(130(148)164-3)50-96(24-80)131(149)165-4)75-188-119-37-87(38-120(61-119)189-76-90-43-113(182-67-81-25-97(132(150)166-5)51-98(26-81)133(151)167-6)58-114(44-90)183-68-82-27-99(134(152)168-7)52-100(28-82)135(153)169-8)73-178-109-18-20-126-124(63-109)144-127(192-126)123-19-17-110(64-125(123)145)179-74-88-39-121(190-77-91-45-115(184-69-83-29-101(136(154)170-9)53-102(30-83)137(155)171-10)59-116(46-91)185-70-84-31-103(138(156)172-11)54-104(32-84)139(157)173-12)62-122(40-88)191-78-92-47-117(186-71-85-33-105(140(158)174-13)55-106(34-85)141(159)175-14)60-118(48-92)187-72-86-35-107(142(160)176-15)56-108(36-86)143(161)177-16/h17-64,145H,65-78H2,1-16H3
InChI key:
JNKPJJPKPSTBRT-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(COc2cc(COc3cc(COc4ccc(c5nc6cc(OCc7cc(OCc8cc(OCc9cc(cc(c9)C(=O)OC)C(=O)OC)cc(OCc9cc(cc(c9)C(=O)OC)C(=O)OC)c8)cc(OCc8cc(OCc9cc(cc(c9)C(=O)OC)C(=O)OC)cc(OCc9cc(cc(c9)C(=O)OC)C(=O)OC)c8)c7)ccc6o5)c(O)c4)cc(OCc4cc(OCc5cc(cc(c5)C(=O)OC)C(=O)OC)cc(OCc5cc(cc(c5)C(=O)OC)C(=O)OC)c4)c3)cc(OCc3cc(cc(c3)C(=O)OC)C(=O)OC)c2)cc(c1)C(=O)OC
Systematic name (3):
2-[2-ヒドロキシ-4-[3,5-ビス[3,5-ビス[3,5-ビス(メトキシカルボニル)ベンジルオキシ]ベンジルオキシ]ベンジルオキシ]フェニル]-5-[3,5-ビス[3,5-ビス[3,5-ビス(メトキシカルボニル)ベンジルオキシ]ベンジルオキシ]ベンジルオキシ]ベンゾオキサゾール
1,3-ジメチル 5-[(3-{[3,5-ビス(メトキシカルボニル)フェニル]メトキシ}-5-[(3-{[3,5-ビス({[3,5-ビス(メトキシカルボニル)フェニル]メトキシ})フェニル]メトキシ}-5-{[4-(5-{[3,5-ビス({[3,5-ビス({[3,5-ビス(メトキシカルボニル)フェニル]メトキシ})フェニル]メトキシ})フェニル]メトキシ}-1,3-ベンゾオキサゾール-2-イル)-3-ヒドロキシフェノキシ]メチル}フェノキシ)メチル]フェノキシ)メチル]ベンゼン-1,3-ジカルボキシラート
1,3-dimethyl 5-[(3-{[3,5-bis(methoxycarbonyl)phenyl]methoxy}-5-[(3-{[3,5-bis({[3,5-bis(methoxycarbonyl)phenyl]methoxy})phenyl]methoxy}-5-{[4-(5-{[3,5-bis({[3,5-bis({[3,5-bis(methoxycarbonyl)phenyl]methoxy})phenyl]methoxy})phenyl]methoxy}-1,3-benzoxazol-2-yl)-3-hydroxyphenoxy]methyl}phenoxy)methyl]phenoxy)methyl]benzene-1,3-dicarboxylate
Other name (1):
2-[2-Hydroxy-4-[3,5-bis[3,5-bis[3,5-bis(methoxycarbonyl)benzyloxy]benzyloxy]benzyloxy]phenyl]-5-[3,5-bis[3,5-bis[3,5-bis(methoxycarbonyl)benzyloxy]benzyloxy]benzyloxy]benzoxazole
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