(Q27131516)

English

glucosyl-heptosyl-(phosphonatoheptosyl)2-(KDO)2-lipid A(10-)

chemical compound

glucosyl-heptosyl3-KDO2-lipid A-bisphosphate(10-)

In more languages

Statements

type of chemical entity

0 references

chemical compound

0 references

3,126.437±0 dalton

1 reference

language of work or name

CHEBI:62000 (English)

7 October 2016

chemical formula

C₁₃₇H₂₄₀N₂O₆₈P₄¹⁰⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCC)CC(=O)OC1C(C(OC(C1OP(=O)([O-])[O-])COC2(CC(C(C(O2)C(CO)O)OC3C(C(C(C(O3)C(CO)O)OP(=O)([O-])[O-])OC4C(C(C(C(O4)C(COC5C(C(C(C(O5)C(CO)O)O)O)O)O)OP(=O)([O-])[O-])OC6C(C(C(C(O6)CO)O)O)O)O)O)OC7(CC(C(C(O7)C(CO)O)O)O)C(=O)[O-])C(=O)[O-])OCC8C(C(C(C(O8)OP(=O)([O-])[O-])NC(=O)CC(CCCCCCCCCCC)O)OC(=O)CC(CCCCCCCCCCC)O)O)NC(=O)CC(CCCCCCCCCCC)OC(=O)CCCCCCCCCCC

1 reference

language of work or name

CHEBI:62000 (English)

7 October 2016

Identifiers

InChI=1S/C137H250N2O68P4/c1-7-13-19-25-31-37-38-44-50-56-62-68-100(156)189-86(66-60-54-48-42-35-29-23-17-11-5)72-102(158)194-123-104(139-98(154)71-85(65-59-53-47-41-34-28-22-16-10-4)188-99(155)67-61-55-49-43-36-30-24-18-12-6)128(186-81-95-107(161)122(193-101(157)70-84(146)64-58-52-46-40-33-27-21-15-9-3)103(129(191-95)207-211(182,183)184)138-97(153)69-83(145)63-57-51-45-39-32-26-20-14-8-2)192-96(121(123)204-208(173,174)175)82-187-136(134(169)170)74-93(201-137(135(171)172)73-87(147)105(159)116(202-137)89(149)76-141)120(119(203-136)91(151)78-143)198-132-113(167)124(126(205-209(176,177)178)117(196-132)90(150)77-142)200-133-114(168)125(199-131-112(166)108(162)106(160)94(79-144)190-131)127(206-210(179,180)181)118(197-133)92(152)80-185-130-111(165)109(163)110(164)115(195-130)88(148)75-140/h83-96,103-133,140-152,159-168H,7-82H2,1-6H3,(H,138,153)(H,139,154)(H,169,170)(H,171,172)(H2,173,174,175)(H2,176,177,178)(H2,179,180,181)(H2,182,183,184)/p-10

1 reference

based on heuristic

inferred from SMILES

PGWHDOSYAOIVFB-QKGFAXFKSA-D

2 references

language of work or name

CHEBI:62000 (English)

7 October 2016

ChEBI release 2020-09-01

1 reference

language of work or name

CHEBI:62000 (English)

7 October 2016

mapping relation type

1 reference

language of work or name

glucosyl-heptosyl-(phosphonatoheptosyl)2-(KDO)2-lipid A(10-) (English)

7 October 2016

UniChem compound ID

1 reference

Sitelinks

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