Chem
J-GLOBAL ID:200907017910806831   Nikkaji number:J1.220.454J

2-O,3-O,6-O-Tribenzoyl-4-O-[2-O,3-O,4-O-tribenzoyl-6-O-[2-O,3-O,6-O-tribenzoyl-4-O-(2-O,3-O,4-O-tribenzoyl-β-D-galactopyranosyl)-α-D-mannopyranosyloxyoxylato(oxo)phosphoranyl]-β-D-galactopyranosyl]-α-D-mannopyranose 1-phosphonic acid 9-decenyl ester

2-O,3-O,6-O-トリベンゾイル-4-O-[2-O,3-O,4-O-トリベンゾイル-6-O-[2-O,3-O,6-O-トリベンゾイル-4-O-(2-O,3-O,4-O-トリベンゾイル-β-D-ガラクトピラノシル)-α-D-マンノピラノシルオキシオキシラト(オキソ)ホスホラニル]-β-D-ガラクトピラノシル]-α-D-マンノピラノース1-ホスホン酸9-デセニル
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: C118H109O37[O-]P2
Molecular formula furigana: C118-H109-O38-P2
Molecular weight: 2197.080
InChI: InChI=1S/C118H110O38P2/c1-2-3-4-5-6-7-8-45-70-137-157(132)155-117-101(151-113(130)85-66-41-19-42-67-85)97(147-109(126)81-58-33-15-34-59-81)93(88(141-117)72-135-103(120)75-46-21-9-22-47-75)154-116-100(150-112(129)84-64-39-18-40-65-84)96(146-108(125)80-56-31-14-32-57-80)92(144-106(123)78-52-27-12-28-53-78)90(140-116)74-138-158(133,134)156-118-102(152-114(131)86-68-43-20-44-69-86)98(148-110(127)82-60-35-16-36-61-82)94(89(142-118)73-136-104(121)76-48-23-10-24-49-76)153-115-99(149-111(128)83-62-37-17-38-63-83)95(145-107(124)79-54-29-13-30-55-79)91(87(71-119)139-115)143-105(122)77-50-25-11-26-51-77/h2,9-44,46-69,87-102,115-119,157H,1,3-8,45,70-74H2,(H,133,134)/p-1/t87-,88-,89-,90-,91+,92+,93-,94-,95+,96+,97+,98+,99-,100-,101+,102+,115+,116+,117-,118-/m1/s1
InChI key: AOLGRNYOLFSZMG-QOHLAVLNSA-M
SMILES: OC[C@H]1O[C@@H](O[C@@H]2[C@@H](COC(=O)c3ccccc3)O[C@H](OP(=O)([O-])OC[C@H]3O[C@@H](O[C@@H]4[C@@H](COC(=O)c5ccccc5)O[C@H](OP(=O)OCCCCCCCCC=C)[C@@H](OC(=O)c5ccccc5)[C@H]4OC(=O)c4ccccc4)[C@H](OC(=O)c4ccccc4)[C@@H](OC(=O)c4ccccc4)[C@H]3OC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1
Systematic name  (3):
  • 2-O,3-O,6-O-トリベンゾイル-4-O-[2-O,3-O,4-O-トリベンゾイル-6-O-[2-O,3-O,6-O-トリベンゾイル-4-O-(2-O,3-O,4-O-トリベンゾイル-β-D-ガラクトピラノシル)-α-D-マンノピラノシルオキシオキシラト(オキソ)ホスホラニル]-β-D-ガラクトピラノシル]-α-D-マンノピラノース1-ホスホン酸9-デセニル
  • (2R,3S,4S,5R,6R)-3,4-ビス(ベンゾイルオキシ)-6-[(ベンゾイルオキシ)メチル]-5-{[(2S,3R,4S,5S,6R)-3,4,5-トリス(ベンゾイルオキシ)-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}オキサン-2-イル [(2R,3S,4S,5R,6S)-3,4,5-トリス(ベンゾイルオキシ)-6-{[(2R,3R,4S,5S,6R)-4,5-ビス(ベンゾイルオキシ)-2-[(ベンゾイルオキシ)メチル]-6-{[(デカ-9-エン-1-イルオキシ)ホスホノイル]オキシ}オキサン-3-イル]オキシ}オキサン-2-イル]メチル ホスファート
  • (2R,3S,4S,5R,6R)-3,4-bis(benzoyloxy)-6-[(benzoyloxy)methyl]-5-{[(2S,3R,4S,5S,6R)-3,4,5-tris(benzoyloxy)-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl [(2R,3S,4S,5R,6S)-3,4,5-tris(benzoyloxy)-6-{[(2R,3R,4S,5S,6R)-4,5-bis(benzoyloxy)-2-[(benzoyloxy)methyl]-6-{[(dec-9-en-1-yloxy)phosphonoyl]oxy}oxan-3-yl]oxy}oxan-2-yl]methyl phosphate
Other name (1):
  • 2-O,3-O,6-O-Tribenzoyl-4-O-[2-O,3-O,4-O-tribenzoyl-6-O-[2-O,3-O,6-O-tribenzoyl-4-O-(2-O,3-O,4-O-tribenzoyl-β-D-galactopyranosyl)-α-D-mannopyranosyloxyoxylato(oxo)phosphoranyl]-β-D-galactopyranosyl]-α-D-mannopyranose 1-phosphonic acid 9-decenyl ester
Thsaurus map:

Return to Previous Page