Chem
J-GLOBAL ID:201807007194765520
Nikkaji number:J3.699.588B
1,1′-Oxybis[1-deoxy-6-O-(3-nonyldodecanoyl)-2-O,3-O,4-O-tri(sulfo)-α-D-glucopyranose]
2,2′,3,3′,4,4′-ヘキサスルホビザンチン
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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:
C54 H102 O31 S6
Molecular formula furigana:
C54-H102-O31-S6
Molecular weight:
1439.740
InChI:
InChI=1S/C54H102O31S6/c1-5-9-13-17-21-25-29-33-41(34-30-26-22-18-14-10-6-2)37-45(55)75-39-43-47(80-86(57,58)59)49(82-88(63,64)65)51(84-90(69,70)71)53(77-43)79-54-52(85-91(72,73)74)50(83-89(66,67)68)48(81-87(60,61)62)44(78-54)40-76-46(56)38-42(35-31-27-23-19-15-11-7-3)36-32-28-24-20-16-12-8-4/h41-44,47-54H,5-40H2,1-4H3,(H,57,58,59)(H,60,61,62)(H,63,64,65)(H,66,67,68)(H,69,70,71)(H,72,73,74)/t43-,44-,47-,48-,49+,50+,51-,52-,53-,54-/m1/s1
InChI key:
IJIDFIIHOMVPSS-PKTVYVHXSA-N
SMILES:
CCCCCCCCCC(CCCCCCCCC)CC(=O)OC[C@H]1O[C@H](O[C@H]2O[C@H](COC(=O)CC(CCCCCCCCC)CCCCCCCCC)[C@@H](OS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H]2OS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@@H](OS(=O)(=O)O)[C@@H]1OS(=O)(=O)O
Systematic name (4):
6-O-(3-ノニルドデカノイル)-2-O,3-O,4-O-トリ(スルホ)-α-D-グルコピラノシル-6-O-(3-ノニルドデカノイル)-2-O,3-O,4-O-トリ(スルホ)-α-D-グルコピラノシド
1,1′-オキシビス[1-デオキシ-6-O-(3-ノニルドデカノイル)-2-O,3-O,4-O-トリ(スルホ)-α-D-グルコピラノース]
[(2R,3R,4S,5R,6R)-6-{[(3-ノニルドデカノイル)オキシ]メチル}-2-{[(2R,3R,4S,5R,6R)-6-{[(3-ノニルドデカノイル)オキシ]メチル}-3,4,5-トリス(スルホオキシ)オキサン-2-イル]オキシ}-4,5-ビス(スルホオキシ)オキサン-3-イル]オキシダンスルホン酸
[(2R,3R,4S,5R,6R)-6-{[(3-nonyldodecanoyl)oxy]methyl}-2-{[(2R,3R,4S,5R,6R)-6-{[(3-nonyldodecanoyl)oxy]methyl}-3,4,5-tris(sulfooxy)oxan-2-yl]oxy}-4,5-bis(sulfooxy)oxan-3-yl]oxidanesulfonic acid
Other name (3):
6-O-(3-Nonyldodecanoyl)-2-O,3-O,4-O-tri(sulfo)-α-D-glucopyranosyl-6-O-(3-nonyldodecanoyl)-2-O,3-O,4-O-tri(sulfo)-α-D-glucopyranoside
2,2′,3,3′,4,4′-ヘキサスルホビザンチン
1,1′-Oxybis[1-deoxy-6-O-(3-nonyldodecanoyl)-2-O,3-O,4-O-tri(sulfo)-α-D-glucopyranose]
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